SCHEMBL11077290

SCHEMBL11077290

CN1CCN(C2CCC(c3cccc(O)c3)(N(C)C)CC2)CC1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 6/20 0.55
OPRL1 P41146 4/20 0.54
OPRK1 P41145 7/20 0.45
OPRM1 P35372 4/20 0.45

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
SCHEMBL11079767 0.89 OPRD1 (0.49) OPRD1OPRL1OPRK1OPRM1
SCHEMBL11066674 0.87 OPRD1 (0.47) OPRD1OPRL1OPRK1OPRM1
SCHEMBL11076003 0.87 OPRD1 (0.47) OPRD1OPRL1OPRM1
SCHEMBL11078596 0.86 OPRL1 (0.72) OPRD1OPRL1OPRK1OPRM1
SCHEMBL11076056 0.85 OPRD1 (0.45) OPRD1OPRL1OPRM1
SCHEMBL11070427 0.85 OPRM1 (0.46) OPRD1OPRL1OPRK1OPRM1
SCHEMBL11079586 0.85 OPRM1 (0.46) OPRD1OPRM1
SCHEMBL11081934 0.84 OPRL1 (0.51) OPRD1OPRL1OPRK1OPRM1
SCHEMBL11075273 0.84 OPRL1 (0.44) OPRD1OPRL1OPRK1OPRM1
SCHEMBL22809117 0.83 OPRD1 (0.67) OPRD1OPRL1OPRK1OPRM1

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
US-4447454-A Analgetic compounds, compositions and process of treatment THE UPJOHN COMPANY (US) 1984-05-08 US disclosed
US-4113866-A ANALGETIC COMPOUNDS, COMPOSITIONS AND PROCESS OF TREATMENT THE UPJOHN COMPANY (US) 1978-09-12 US disclosed