SCHEMBL4725192

SCHEMBL4725192

C=CCN1CCCC1[C@@H](OC(=O)C(C)(C)C)c1cccc(OC)c1

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 5/20 0.46
OPRM1 P35372 3/20 0.46

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
SCHEMBL4725189 1.00 OPRD1 (0.46) OPRD1OPRM1
SCHEMBL4782508 0.82 OPRD1 (0.38) OPRD1OPRM1
SCHEMBL4777152 0.81 POLB (0.41)
SCHEMBL4777150 0.81 POLB (0.41)
SCHEMBL4725288 0.81 OPRD1 (0.47) OPRD1OPRM1
SCHEMBL4725294 0.81 OPRD1 (0.47) OPRD1OPRM1
SCHEMBL4781023 0.79 OPRD1 (0.47) OPRD1OPRM1
SCHEMBL22557476 0.78 OPRD1 (0.49) OPRD1OPRM1
SCHEMBL22557475 0.78 OPRD1 (0.49) OPRD1OPRM1
SCHEMBL4779720 0.78 OPRD1 (0.49) OPRD1OPRM1

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
WO-2008018639-A2 GLYCINE TRANSPORTER INHIBITOR TAISHO PHARMACEUTICAL CO., LTD. (JP) 2008-02-14 WO disclosed