SCHEMBL7968541

SCHEMBL7968541

CN(CCCc1ccccc1)C(=O)C(Cc1ccc2ccccc2c1)N(C)C(=O)OC(C)(C)C

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 7/20 0.56
LTB4R Q15722 1/20 0.42
LTB4R2 Q9NPC1 1/20 0.42
CTSB P07858 1/20 0.42
CTSS P25774 1/20 0.42
CTSK P43235 1/20 0.42
BCHE P06276 3/20 0.42
SIGMAR1 Q99720 2/20 0.42
MC4R P32245 2/20 0.41
MC5R P33032 2/20 0.41
MC3R P41968 2/20 0.41

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
SCHEMBL7648623 1.00 GHSR (0.56) GHSRLTB4RLTB4R2CTSBCTSS
SCHEMBL7647039 0.94 GHSR (0.63) GHSRLTB4RLTB4R2CTSBCTSS
SCHEMBL7964337 0.90 GHSR (0.50) GHSRLTB4RLTB4R2CTSBCTSS
SCHEMBL7964340 0.90 GHSR (0.50) GHSRLTB4RLTB4R2CTSBCTSS
SCHEMBL7169394 0.86 GHSR (0.55) GHSRLTB4RLTB4R2CTSBCTSS
SCHEMBL6317705 0.84 GHSR (0.48) GHSRCTSBCTSSCTSK
SCHEMBL6661365 0.83 GHSR (0.50) GHSRLTB4RLTB4R2CTSBCTSS
SCHEMBL31407327 0.83 CTSB (0.49) GHSRCTSBCTSSCTSK
SCHEMBL29624575 0.83 CTSB (0.49) GHSRCTSBCTSSCTSK
SCHEMBL3266674 0.83 CTSB (0.49) GHSRCTSBCTSSCTSK

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-6274584-B1 PEPTIDE DERIVATIVES; BIOAVAILABILITY; ENZYME RESISTANCE; MILK AND WOOL PRODUCTION NOVO NORDISK A/S (DK) 2001-08-14 US disclosed