SCHEMBL17612703

SCHEMBL17612703

CCCC[C@H]1NC(=O)[C@@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 10/20 0.56
▸ MC5R P33032 10/20 0.56
▸ MC3R P41968 10/20 0.56
▸ MC1R Q01726 10/20 0.56
▸ ITGB3 P05106 6/20 0.56
▸ ITGA2B P08514 5/20 0.56
▸ CACNA1B Q00975 1/20 0.50
▸ CTSG P08311 1/20 0.50
▸ ITGAV P06756 1/20 0.49
▸ ITGB5 P18084 1/20 0.49
▸ NNMT P40261 1/20 0.49
▸ KDM4A O75164 1/20 0.49

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
SCHEMBL16152202 0.97 ITGB3 (0.55) MC4RMC5RMC3RMC1RITGB3
SCHEMBL29393726 0.96 ITGB3 (0.59) MC4RMC5RMC3RMC1RITGB3
SCHEMBL10259650 0.93 MC4R (0.62) MC4RMC5RMC3RMC1RITGB3
SCHEMBL15308349 0.93 ITGB3 (0.53) MC4RMC5RMC3RMC1RITGB3
SCHEMBL16301538 0.93 ITGB3 (0.55) MC4RMC5RMC3RMC1RITGB3
SCHEMBL10049936 0.92 ITGB3 (0.56) MC4RMC5RMC3RMC1RITGB3
SCHEMBL16135323 0.92 ITGB3 (0.54) MC4RMC5RMC3RMC1RITGB3
SCHEMBL15160074 0.92 ITGB3 (0.54) MC4RMC5RMC3RMC1RITGB3
SCHEMBL19412647 0.92 ITGB3 (0.54) MC4RMC5RMC3RMC1RITGB3
SCHEMBL23839922 0.92 ITGB3 (0.56) MC4RMC5RMC3RMC1RITGB3

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
US-9289515-B2 Multivalent fluorescent probes CALIPER LIFE SCIENCES (US) 2016-03-22 — — US disclosed
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