Exploring monocyclic core: Discovery of pyrrol-2-one derivatives as a new series of potent MCHR1 antagonists with in vivo efficacy

Eur J Med Chem. 2024 Oct 5:276:116686. doi: 10.1016/j.ejmech.2024.116686. Epub 2024 Jul 20.

Abstract

With an objective to improve the profiles of the 1st generation non-basic MCHR1 antagonists, a lean design approach of replacing the bicyclic thienopyrimidine core with a monocyclic pyrrol-2-one chemotype was examined in the context of reducing aromatic ring count, while also contemplating enhanced flexibility as a means of decreasing flat character. The new compounds exhibited potent antagonism up to the sub-nanomolar range, thereby implying that the monocyclic ring could effectively serve as an effective bioisostere of the bicyclic system. The prototype compound 2m offered benefits like improved potency, reduced half-life, and enhanced solubility, while also demonstrating >5% reduction in weight gain in rats, thereby providing proof-of-concept for this new class of compounds as anti-obesity agents.

Keywords: Antagonists; Anti-obesity; CNS; MCHR1; Melanin-concentrating hormone; Off-rate; Pyrrol-2-one.

MeSH terms

  • Animals
  • Anti-Obesity Agents / chemical synthesis
  • Anti-Obesity Agents / chemistry
  • Anti-Obesity Agents / pharmacology
  • Dose-Response Relationship, Drug
  • Drug Discovery
  • Humans
  • Male
  • Molecular Structure
  • Pyrroles* / chemical synthesis
  • Pyrroles* / chemistry
  • Pyrroles* / pharmacology
  • Rats
  • Rats, Sprague-Dawley
  • Receptors, Somatostatin
  • Structure-Activity Relationship

Substances

  • Pyrroles
  • Anti-Obesity Agents
  • MCHR1 protein, human
  • Receptors, Somatostatin