SCHEMBL10465313

SCHEMBL10465313

C[C@@H]1CN(CCc2ccccc2)CC[C@@H]1N(C(=O)C1CC1)c1ccccn1

nearest known ligand 0.63

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.63
OPRD1 P41143 1/20 0.63
OPRK1 P41145 1/20 0.63

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
SCHEMBL10465311 1.00 OPRM1 (0.63) OPRM1OPRD1OPRK1
SCHEMBL10465312 1.00 OPRM1 (0.63) OPRM1OPRD1OPRK1
SCHEMBL10464363 0.92 OPRM1 (0.67) OPRM1OPRD1OPRK1
SCHEMBL10464365 0.92 OPRM1 (0.67) OPRM1OPRD1OPRK1
SCHEMBL10464364 0.92 OPRM1 (0.67) OPRM1OPRD1OPRK1
SCHEMBL10464822 0.85 OPRM1 (0.56) OPRM1OPRD1OPRK1
SCHEMBL10464823 0.85 OPRM1 (0.56) OPRM1OPRD1OPRK1
SCHEMBL10464824 0.85 OPRM1 (0.56) OPRM1OPRD1OPRK1
SCHEMBL10462669 0.83 OPRM1 (0.57) OPRM1OPRD1OPRK1
SCHEMBL10462667 0.83 OPRM1 (0.57) OPRM1OPRD1OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4916142-A N-heterocyclic-N-(4-piperidinyl)amides and pharmaceutical compositions and their use as analgesics BOC, INC. (US) 1990-04-10 US claimed
US-4954506-A ANALGESICS, NARCOTIC ANTAGONISTS BOC, INC. (US) 1990-09-04 US disclosed
US-4916142-A N-heterocyclic-N-(4-piperidinyl)amides and pharmaceutical compositions and their use as analgesics BOC, INC. (US) 1990-04-10 US disclosed
US-4912109-A Narcotic antagonist BOC, INC. (US) 1990-03-27 US disclosed