SCHEMBL5307882

SCHEMBL5307882

Cc1c(Cl)c(C(F)(F)F)nn1C(C=O)N1CCC(O)(c2ccccc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 18/20 0.43
OPRK1 P41145 18/20 0.43
OPRL1 P41146 18/20 0.43
OPRD1 P41143 17/20 0.43
CCR1 P32246 1/20 0.39

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
SCHEMBL5379498 0.85 CCR1 (0.40) OPRM1OPRK1OPRD1CCR1
SCHEMBL5312337 0.84 CCR1 (0.48) OPRM1OPRK1OPRD1CCR1
SCHEMBL5307635 0.84 CCR1 (0.39) OPRM1OPRK1OPRD1CCR1
SCHEMBL4019904 0.81 CCR1 (0.53) CCR1
SCHEMBL5313190 0.80 CCR1 (0.37) CCR1
SCHEMBL5362249 0.80 CCR1 (0.39) CCR1
SCHEMBL5311863 0.79 CCR1 (0.42) OPRL1CCR1
SCHEMBL5310532 0.78 F10 (0.38) CCR1
SCHEMBL4019925 0.78 CCR1 (0.40) CCR1
SCHEMBL5314510 0.77 HSD11B1 (0.48) CCR1

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
WO-2007073432-A2 PIPERIDINE DERIVATIVES AND METHODS OF USE CHEMOCENTRYX, INC. (US) 2007-06-28 WO disclosed
WO-2007044804-A2 PIPERIDINE DERIVATIVES AND METHODS OF USE CHEMOCENTRYX, INC. (US) 2007-04-19 WO disclosed