SCHEMBL8145353

SCHEMBL8145353

CCCN1CCC(N(c2ccccc2)c2ccc(C(=O)N(CC)CC)cc2)CC1

nearest known ligand 0.74

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 18/20 0.74
OPRM1 P35372 15/20 0.74
OPRK1 P41145 14/20 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
Fumaric Acid SCHEMBL6172923 0.95 OPRD1 (0.71) OPRD1OPRM1OPRK1
Fumaric Acid SCHEMBL6172924 0.95 OPRD1 (0.71) OPRD1OPRM1OPRK1
SCHEMBL6395155 0.90 OPRD1 (0.85) OPRD1OPRM1OPRK1
SCHEMBL6173648 0.89 OPRM1 (0.84) OPRD1OPRM1OPRK1
Oxalic Acid SCHEMBL6176266 0.88 OPRM1 (0.78) OPRD1OPRM1OPRK1
SCHEMBL6394863 0.87 OPRD1 (0.88) OPRD1OPRM1OPRK1
SCHEMBL6175709 0.87 OPRM1 (0.82) OPRD1OPRM1OPRK1
Fumaric Acid SCHEMBL6174165 0.86 OPRM1 (0.76) OPRD1OPRM1OPRK1
Fumaric Acid SCHEMBL6174172 0.86 OPRM1 (0.76) OPRD1OPRM1OPRK1
SCHEMBL4497092 0.84 OPRD1 (0.60) OPRD1OPRM1OPRK1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1049676-A1 4- ARYL(PIPERIDIN-4-YL)] AMINOBENZAMIDES WHICH BIND TO THE DELTA-OPIOID RECEPTOR Ortho-Mcneil Pharmaceutical, Inc. (US) 2000-11-08 EP disclosed
WO-1999033806-A1 4-[ARYL(PIPERIDIN-4-YL)] AMINOBENZAMIDES WHICH BIND TO THE DELTA-OPIOID RECEPTOR ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 1999-07-08 WO disclosed