SCHEMBL18255448

SCHEMBL18255448

Cc1c(NC(=O)NOCc2ccccc2)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 9/20 0.56
CNR1 P21554 8/20 0.56
PPARA Q07869 2/20 0.52

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
SCHEMBL18255429 0.87 CNR1 (0.63) CNR2CNR1
SCHEMBL18255407 0.85 CNR2 (0.61) CNR2CNR1PPARA
SCHEMBL18255458 0.84 CNR1 (0.60) CNR2CNR1PPARA
SCHEMBL18255446 0.81 CNR1 (0.56) CNR2CNR1PPARA
SCHEMBL18255445 0.80 CNR2 (0.62) CNR2CNR1PPARA
SCHEMBL18255367 0.79 CNR2 (0.70) CNR2CNR1PPARA
SCHEMBL18255370 0.79 CNR2 (0.52) CNR2CNR1
SCHEMBL18255457 0.79 CNR2 (0.55) CNR2CNR1PPARA
SCHEMBL18255410 0.79 CNR1 (0.57) CNR2CNR1
SCHEMBL18255430 0.78 RAB9A (0.56) CNR2CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016184310-A1 4-METHYL-1H-DIARYL PYRAZOLE DERIVATIVES AND USES AS DRUGS THEREOF 中国人民解放军军事医学科学院毒物药物研究所 2016-11-24 WO disclosed