SCHEMBL4483783

SCHEMBL4483783

Cc1cc(CNCCC2CCOCC2)ccc1-c1ccc(C(N)=O)cc1C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 4/20 0.56
OPRD1 P41143 3/20 0.56
OPRK1 P41145 3/20 0.56
EGLN1 Q9GZT9 2/20 0.39
CHUK O15111 1/20 0.38
INSR P06213 1/20 0.38
MAPK8 P45983 1/20 0.38
CAMKK2 Q96RR4 1/20 0.38
BCHE P06276 1/20 0.37
ACHE P22303 1/20 0.37
MAOB P27338 1/20 0.37
MCHR1 Q99705 1/20 0.37
OPRL1 P41146 2/20 0.37
BRD4 O60885 1/20 0.36
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
CHEK2 O96017 1/20 0.36
MAPK1 P28482 1/20 0.35
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL4481852 0.92 OPRM1 (0.57) OPRM1OPRD1OPRK1EGLN1CHUK
SCHEMBL4492023 0.90 OPRM1 (0.45) OPRM1OPRD1OPRK1EGLN1CHUK
SCHEMBL4075945 0.86 OPRM1 (0.57) OPRM1OPRD1OPRK1MCHR1OPRL1
SCHEMBL4071701 0.84 OPRM1 (0.47) OPRM1OPRD1OPRK1
SCHEMBL4074406 0.83 OPRM1 (0.46) OPRM1OPRD1OPRK1EGLN1OPRL1
SCHEMBL4256842 0.81 OPRM1 (0.45) OPRM1OPRD1OPRK1EGLN1OPRL1
SCHEMBL4083677 0.81 OPRM1 (0.57) OPRM1OPRD1OPRK1OPRL1CHRM2
SCHEMBL4078358 0.80 OPRM1 (0.51) OPRM1OPRD1OPRK1OPRL1CHRM2
SCHEMBL4965903 0.79 OPRM1 (0.61) OPRM1OPRD1OPRK1ACHEMCHR1
SCHEMBL1348506 0.78 OPRM1 (0.42) OPRM1OPRD1OPRK1BRD4

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-7615651-B2 Diaryl, dipyridinyl and aryl-pyridinyl derivatives and uses thereof PFIZER INC. (US) 2009-11-10 US claimed