Structure-activity relationship studies of pyrrolone antimalarial agents

ChemMedChem. 2013 Sep;8(9):1537-44. doi: 10.1002/cmdc.201300177. Epub 2013 Aug 5.

Abstract

Previously reported pyrrolones, such as TDR32570, exhibited potential as antimalarial agents; however, while these compounds have potent antimalarial activity, they suffer from poor aqueous solubility and metabolic instability. Here, further structure-activity relationship studies are described that aimed to solve the developability issues associated with this series of compounds. In particular, further modifications to the lead pyrrolone, involving replacement of a phenyl ring with a piperidine and removal of a potentially metabolically labile ester by a scaffold hop, gave rise to derivatives with improved in vitro antimalarial activities against Plasmodium falciparum K1, a chloroquine- and pyrimethamine-resistant parasite strain, with some derivatives exhibiting good selectivity for parasite over mammalian (L6) cells. Three representative compounds were selected for evaluation in a rodent model of malaria infection, and the best compound showed improved ability to decrease parasitaemia and a slight increase in survival.

Keywords: Plasmodium falciparum; antiprotozoal agents; malaria; pyrrolones; structure-activity relationships.

Publication types

  • Research Support, Non-U.S. Gov't

MeSH terms

  • Animals
  • Antimalarials / chemical synthesis
  • Antimalarials / chemistry*
  • Antimalarials / pharmacokinetics
  • Chloroquine / pharmacology
  • Drug Resistance / drug effects
  • Half-Life
  • Mice
  • Microsomes, Liver / metabolism
  • Plasmodium falciparum / drug effects
  • Pyrimethamine / pharmacology
  • Pyrroles / chemical synthesis
  • Pyrroles / chemistry*
  • Pyrroles / pharmacokinetics
  • Pyrroles / pharmacology
  • Structure-Activity Relationship

Substances

  • Antimalarials
  • Pyrroles
  • ethyl 5-((2,5-dimethyl-1-(2-(trifluoromethyl)phenyl)pyrrol-3-yl)methylene)-2-methyl-4-oxo-1H-pyrrole-3-carboxylate
  • Chloroquine
  • Pyrimethamine