SCHEMBL1920864

SCHEMBL1920864

COC(=O)[C@@H]1CN(C(C)(C)C)C[C@H]1c1ccc(F)cc1F

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MC4R P32245 18/20 0.59
MC3R P41968 7/20 0.59
MC5R P33032 7/20 0.59
MC1R Q01726 7/20 0.59
KCNH2 Q12809 4/20 0.59
PRCP P42785 1/20 0.52

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL18914642 1.00 MC4R (0.59) MC4RMC3RMC5RMC1RKCNH2
SCHEMBL14598633 0.90 MC4R (0.55) MC4RMC3RMC5RMC1RKCNH2
SCHEMBL20235934 0.89 MC4R (0.48) MC4RMC3RMC5RMC1RKCNH2
SCHEMBL18914510 0.89 MC4R (0.48) MC4RMC3RMC5RMC1RKCNH2
SCHEMBL18914504 0.89 MC4R (0.48) MC4RMC3RMC5RMC1RKCNH2
SCHEMBL18914527 0.89 MC4R (0.49) MC4RMC3RMC5RMC1RKCNH2
SCHEMBL12536886 0.88 MC4R (0.55) MC4RMC3RMC5RMC1RKCNH2
SCHEMBL18914506 0.88 MC4R (0.50) MC4RMC3RMC5RMC1RKCNH2
SCHEMBL18914509 0.87 MC4R (0.49) MC4RMC3RMC5RMC1RKCNH2
SCHEMBL18914518 0.87 MC4R (0.49) MC4RMC3RMC5RMC1RKCNH2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1716135-B1 PIPERIDINYLCARBONYL-PYRROLIDINES AND THEIR USE AS MELANOCORTIN AGONISTS PFIZER LTD (GB) 2011-06-01 EP disclosed
US-7649002-B2 (3,5-dimethylpiperidin-1yl)(4-phenylpyrrolidin-3-yl)methanone derivatives as MCR4 agonists PFIZER INC (US) 2010-01-19 US disclosed
US-7419990-B2 Piperidine derivatives as melanocortin-4 receptor agonists MERCK & CO., INC. (US) 2008-09-02 US disclosed
US-7419990-B2 Piperidine derivatives as melanocortin-4 receptor agonists MERCK & CO., INC. (US) 2008-09-02 US disclosed
US-7329673-B2 Acylated spiropiperidine derivatives as melanocortin-4 receptor agonists MERCK & CO., INC. (US) 2008-02-12 US disclosed
US-7329673-B2 Acylated spiropiperidine derivatives as melanocortin-4 receptor agonists MERCK & CO., INC. (US) 2008-02-12 US disclosed