SCHEMBL4722688

SCHEMBL4722688

CCCC1CCC(N2CCC(N3C(=O)C(C)c4ccccc43)CC2)CC1

nearest known ligand 0.70

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 18/20 0.70
OPRL1 P41146 17/20 0.70
OPRK1 P41145 15/20 0.70

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
SCHEMBL1868715 0.87 OPRM1 (0.75) OPRM1OPRL1OPRK1
SCHEMBL10063519 0.79 OPRM1 (0.66) OPRM1OPRL1OPRK1
SCHEMBL2674961 0.77 OPRM1 (0.71) OPRM1OPRL1OPRK1
SCHEMBL3870697 0.77 OPRL1 (0.81) OPRM1OPRL1OPRK1
SCHEMBL1863063 0.76 OPRL1 (0.60) OPRM1OPRL1OPRK1
SCHEMBL1863062 0.76 OPRL1 (0.60) OPRM1OPRL1OPRK1
SCHEMBL1858997 0.76 OPRM1 (0.55) OPRM1OPRL1OPRK1
SCHEMBL1859441 0.71 OPRM1 (1.00) OPRM1OPRL1OPRK1
SCHEMBL21179610 0.70 OPRM1 (0.60) OPRM1OPRL1OPRK1
SCHEMBL19840117 0.70 OPRM1 (0.58) OPRM1OPRL1OPRK1

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
EP-1379246-B1 NOCICEPTIN ANALOGS EURO CELTIQUE SA (LU) 2008-10-08 EP disclosed