SCHEMBL3145153

SCHEMBL3145153

CCOC(=O)ON1CCC(N[C@H](Cc2ccc(Cl)cc2)C(=O)N2CCC(Cn3cncn3)(C3CCCCC3)CC2)CC1

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MC4R P32245 18/20 0.65
MC3R P41968 8/20 0.64
MC1R Q01726 8/20 0.64
MC5R P33032 7/20 0.39
ALDH1A1 P00352 2/20 0.38
HTT P42858 1/20 0.38
KDM4E B2RXH2 1/20 0.37
CYP3A4 P08684 1/20 0.36

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
SCHEMBL3156665 0.94 MC4R (0.68) MC4RMC3RMC1RMC5RALDH1A1
SCHEMBL3156125 0.92 MC4R (0.68) MC4RMC3RMC1RMC5RALDH1A1
SCHEMBL3147970 0.91 MC4R (0.68) MC4RMC3RMC1RMC5RALDH1A1
SCHEMBL3151159 0.89 MC4R (0.68) MC4RMC3RMC1RMC5RALDH1A1
SCHEMBL3148275 0.89 MC4R (0.68) MC4RMC3RMC1RMC5RALDH1A1
SCHEMBL3148268 0.89 MC4R (0.68) MC4RMC3RMC1RMC5RALDH1A1
SCHEMBL3143486 0.88 MC4R (0.78) MC4RMC3RMC1RMC5RALDH1A1
SCHEMBL3153936 0.87 MC4R (0.70) MC4RMC3RMC1RMC5RALDH1A1
SCHEMBL3148202 0.87 MC4R (0.72) MC4RMC3RMC1RMC5RALDH1A1
SCHEMBL3142002 0.87 MC4R (0.74) MC4RMC3RMC1RMC5RALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1773796-B1 OXOPIPERIDINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI AVENTIS (FR) 2010-03-03 EP claimed