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Sugi Predict / Compounds / SCHEMBL3156512

SCHEMBL3156512

SCHEMBL3156512

O=C([C@@H](Cc1ccc(Cl)cc1)NC1CCC2(CC1)C(=O)CCC2=O)N1CCC(Cn2cncn2)(C2CCCCC2)CC1

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 18/20 0.69
▸ MC3R P41968 8/20 0.69
▸ MC1R Q01726 8/20 0.69
▸ MC5R P33032 7/20 0.42
▸ CYP3A4 P08684 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38

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
SCHEMBL3149435 0.92 MC4R (0.73) MC4RMC3RMC1RMC5RCYP3A4
SCHEMBL3143486 0.92 MC4R (0.78) MC4RMC3RMC1RMC5RCYP3A4
SCHEMBL5476127 0.91 MC4R (0.73) MC4RMC3RMC1RMC5RCYP3A4
Bicarbonate SCHEMBL3149384 0.91 MC4R (0.76) MC4RMC3RMC1RMC5RALDH1A1
SCHEMBL3148460 0.90 MC4R (0.72) MC4RMC3RMC1RMC5RCYP3A4
SCHEMBL3152966 0.89 MC4R (0.73) MC4RMC3RMC1RMC5RCYP3A4
SCHEMBL3152961 0.89 MC4R (0.73) MC4RMC3RMC1RMC5RCYP3A4
SCHEMBL3156471 0.89 MC4R (0.78) MC4RMC3RMC1RMC5RCYP3A4
SCHEMBL3157806 0.89 MC4R (0.73) MC4RMC3RMC1RMC5RCYP3A4
SCHEMBL5476125 0.89 MC4R (0.73) MC4RMC3RMC1RMC5RCYP3A4

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