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SCHEMBL6822865

SCHEMBL6822865

CC(C)(C)OC(=O)NC(Cc1ccc(Cl)cc1Cl)C(=O)N1CCN(C2CCC(C(=O)O)CC2)CC1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 11/20 0.60
▸ UGCG Q16739 2/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ KMT2A Q03164 2/20 0.45
▸ MC3R P41968 3/20 0.44
▸ HRH2 P25021 1/20 0.44
▸ HRH1 P35367 1/20 0.44
▸ EPHX2 P34913 1/20 0.43
▸ MC5R P33032 1/20 0.43
▸ MAPK1 P28482 1/20 0.42

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
SCHEMBL6739687 0.86 MC4R (0.60) MC4RUGCGCYP3A4KMT2AMC3R
SCHEMBL6739684 0.86 MC4R (0.60) MC4RUGCGCYP3A4KMT2AMC3R
SCHEMBL6739689 0.86 MC4R (0.60) MC4RUGCGCYP3A4KMT2AMC3R
SCHEMBL16825980 0.86 MC4R (0.69) MC4RUGCGCYP3A4MC3RMC5R
SCHEMBL6738398 0.83 MC4R (0.58) MC4RUGCGCYP3A4KMT2AMC3R
SCHEMBL6738395 0.83 MC4R (0.58) MC4RUGCGCYP3A4KMT2AMC3R
SCHEMBL6730396 0.82 MC4R (0.59) MC4RUGCGCYP3A4MC3RMC5R
SCHEMBL6730395 0.82 MC4R (0.59) MC4RUGCGCYP3A4MC3RMC5R
SCHEMBL21674357 0.81 MC4R (0.66) MC4RUGCGCYP3A4MC3RMC5R
SCHEMBL16846207 0.81 MC4R (0.66) MC4RUGCGCYP3A4MC3RMC5R

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
WO-2004058735-A2 LIGANDS OF MELANOCORTIN RECEPTORS AND COMPOSITIONS AND METHODS RELATED THERETO NEUROCRINE BIOSCIENCES, INC. (US) 2004-07-15 — — WO disclosed