SCHEMBL7621657

SCHEMBL7621657

CCCCCCN1CCC(C)(c2ccc(N)c(N)c2)C(C)C1

nearest known ligand 0.69

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 3/20 0.51
OPRK1 P41145 2/20 0.51
OPRD1 P41143 2/20 0.49

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
SCHEMBL7621660 1.00 OPRM1 (0.51) OPRM1OPRK1OPRD1
SCHEMBL6653618 0.92 OPRM1 (0.48) OPRM1OPRK1OPRD1
SCHEMBL6653615 0.92 OPRM1 (0.48) OPRM1OPRK1OPRD1
SCHEMBL7619540 0.91 OPRM1 (0.47) OPRM1OPRK1OPRD1
SCHEMBL7619546 0.91 OPRM1 (0.47) OPRM1OPRK1OPRD1
SCHEMBL7619453 0.90 OPRM1 (0.52) OPRM1OPRD1
SCHEMBL7619449 0.90 OPRM1 (0.52) OPRM1OPRD1
SCHEMBL7623433 0.86 OPRM1 (0.44) OPRM1OPRK1OPRD1
SCHEMBL7623428 0.86 OPRM1 (0.44) OPRM1OPRK1OPRD1
SCHEMBL6532475 0.86 OPRM1 (0.69) OPRM1OPRK1OPRD1

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-6441000-B1 DISEASES MEDIATED BY OPIATE RECEPTORS PFIZER INC 2002-08-27 US disclosed
EP-1055668-A1 New 4-arylpiperidine derivatives for the treatment of pruritus PFIZER INC. (US) 2000-11-29 EP disclosed