SCHEMBL8024043

SCHEMBL8024043

Cc1cc(O)cc(Cl)c1C[C@H](N)C(=O)N1CCc2ccccc21

nearest known ligand 0.76

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 14/20 0.76
OPRM1 P35372 10/20 0.76
OPRD1 P41143 9/20 0.76

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
SCHEMBL8017467 1.00 OPRK1 (0.76) OPRK1OPRM1OPRD1
SCHEMBL8017469 1.00 OPRK1 (0.76) OPRK1OPRM1OPRD1
SCHEMBL8017641 0.92 OPRK1 (0.87) OPRK1OPRM1OPRD1
SCHEMBL8017637 0.92 OPRK1 (0.87) OPRK1OPRM1OPRD1
SCHEMBL8018359 0.92 OPRK1 (0.87) OPRK1OPRM1OPRD1
SCHEMBL8017072 0.88 OPRK1 (0.76) OPRK1OPRM1OPRD1
SCHEMBL8018224 0.88 OPRK1 (0.76) OPRK1OPRM1OPRD1
SCHEMBL8017074 0.88 OPRK1 (0.76) OPRK1OPRM1OPRD1
SCHEMBL8007860 0.87 OPRK1 (0.60) OPRK1OPRM1OPRD1
SCHEMBL8021639 0.87 OPRK1 (0.60) OPRK1OPRM1OPRD1

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-6114381-A TO CONTROL BRAIN DAMAGE ASSOCIATED WITH ANOXIA OR ISCHEMIA WHICH TYPICALLY FOLLOWS STROKE, CARDIAC ARREST OR PERINATAL ASPHYXIA; COMPOUND IS AN ANTAGONIST TO INHIBIT EXCITOTOXIC ACTIONS AT EXCITATORY AMINO ACID RECEPTOR SITES G. D. SEARLE & CO. (US) 2000-09-05 US disclosed