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SCHEMBL4803553

SCHEMBL4803553

CC(=O)OCCCC[C@H]1CN(C(=O)[C@H](N)Cc2ccc3ccccc3c2)[C@H](C)CN1C(=O)[C@H](N)Cc1ccc2ccccc2c1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MC3R P41968 15/20 0.49
▸ MC4R P32245 14/20 0.49
▸ MC1R Q01726 14/20 0.49
▸ DPP4 P27487 1/20 0.46
▸ OPRD1 P41143 2/20 0.41
▸ OPRM1 P35372 1/20 0.39
▸ OPRK1 P41145 1/20 0.39
▸ SSTR4 P31391 1/20 0.39
▸ SSTR5 P35346 1/20 0.39

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
SCHEMBL14147759 1.00 MC3R (0.49) MC3RMC4RMC1RDPP4OPRD1
SCHEMBL4803562 1.00 MC3R (0.49) MC3RMC4RMC1RDPP4OPRD1
SCHEMBL4738848 0.89 MC3R (0.49) MC3RMC4RMC1RDPP4OPRD1
SCHEMBL4738854 0.89 MC3R (0.49) MC3RMC4RMC1RDPP4OPRD1
SCHEMBL4785506 0.88 MC3R (0.50) MC3RMC4RMC1RDPP4OPRD1
SCHEMBL4785499 0.88 MC3R (0.50) MC3RMC4RMC1RDPP4OPRD1
SCHEMBL4785504 0.88 MC3R (0.50) MC3RMC4RMC1RDPP4OPRD1
SCHEMBL4738860 0.86 DPP4 (0.37) MC3RMC4RMC1RDPP4OPRD1
SCHEMBL1748662 0.84 MC4R (0.47) MC3RMC4RMC1RDPP4OPRD1
SCHEMBL1748661 0.84 MC4R (0.47) MC3RMC4RMC1RDPP4OPRD1

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-2008090357-A2 N, N; -SUBSTITUTED PIPERAZINES BINDING TO MELANOCORTIN RECEPTOR PALATIN TECHNOLOGIES, INC. (US) 2008-07-31 — — WO disclosed