SCHEMBL4680189

SCHEMBL4680189

CN1C(=O)NCC1c1ccccc1C1CCN(C(=O)[C@@H](CCc2ccc(Cl)cc2)NC=O)C[C@H]1C1NCCc2ccccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MC4R P32245 11/20 0.37
MC3R P41968 5/20 0.37
MC5R P33032 4/20 0.35
MC1R Q01726 4/20 0.35
ALDH1A1 P00352 1/20 0.33
PSMB11 A5LHX3 3/20 0.33
PSMA7 O14818 3/20 0.33
PSMB1 P20618 3/20 0.33
PSMA1 P25786 3/20 0.33
PSMA2 P25787 3/20 0.33
PSMA3 P25788 3/20 0.33
PSMA4 P25789 3/20 0.33
PSMB8 P28062 3/20 0.33
PSMB9 P28065 3/20 0.33
PSMA5 P28066 3/20 0.33
PSMB4 P28070 3/20 0.33
PSMB6 P28072 3/20 0.33
PSMB5 P28074 3/20 0.33
PSMB10 P40306 3/20 0.33
PSMB3 P49720 3/20 0.33

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
SCHEMBL4698319 0.94 MC4R (0.41) MC4RMC3RMC5RMC1RCYP3A4
SCHEMBL4698284 0.81 MC4R (0.40) MC4RMC3RMC5RMC1RALDH1A1
SCHEMBL4699797 0.73 TACR1 (0.46) MC4RMC3RMC5RMC1ROPRM1
SCHEMBL4514425 0.66 MC4R (0.43) MC4RMC3RMC5RMC1R
SCHEMBL4530098 0.66 MC4R (0.43) MC4RMC3RMC5RMC1R
SCHEMBL4703101 0.63 KMT2A (0.49) MC4RMC3RMC5RMC1RCCR1
SCHEMBL4700274 0.62 MC4R (0.41) MC4RMC3RMC5RMC1RCCR1
SCHEMBL3235874 0.62 MC4R (0.65) MC4RMC3RMC5RMC1R
SCHEMBL3235881 0.62 MC4R (0.65) MC4RMC3RMC5RMC1R
SCHEMBL3239970 0.62 MC4R (0.65) MC4RMC3RMC5RMC1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1416933-B8 SUBSTITUTED PIPERIDINES AS MODULATORS OF THE MELANOCORTIN RECEPTOR AMGEN INC (US) 2008-08-27 EP disclosed
EP-1416933-A1 SUBSTITUTED PIPERIDINES AS MODULATORS OF THE MELANOCORTIN RECEPTOR Amgem, Inc. (US) 2004-05-12 EP disclosed
WO-2003009847-A1 SUBSTITUTED PIPERIDINES AS MODULATORS OF THE MELANOCORTIN RECEPTOR AMGEM, INC. (US) 2003-02-06 WO disclosed