SCHEMBL29838937

SCHEMBL29838937

COC(=O)c1ccc(NC(=O)c2nn(-c3ccc(Cl)cc3Cl)c(-c3ccc(Cl)cc3)c2C)nc1

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 11/20 0.66
CNR2 P34972 11/20 0.66
PPARA Q07869 2/20 0.64

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
SCHEMBL29838939 0.91 CNR2 (0.68) CNR1CNR2PPARA
SCHEMBL29838962 0.88 CNR2 (0.67) CNR1CNR2PPARA
SCHEMBL29838948 0.88 CNR1 (0.79) CNR1CNR2PPARA
SCHEMBL29838957 0.87 CNR2 (0.66) CNR1CNR2PPARA
SCHEMBL29838946 0.85 CNR1 (0.65) CNR1CNR2PPARA
SCHEMBL29838952 0.85 CNR1 (0.65) CNR1CNR2PPARA
SCHEMBL29838961 0.85 CNR2 (0.70) CNR1CNR2PPARA
SCHEMBL4612022 0.84 CNR1 (0.76) CNR1CNR2PPARA
SCHEMBL29838863 0.84 CNR1 (0.67) CNR1CNR2
SCHEMBL29838953 0.84 CNR2 (0.80) CNR1CNR2PPARA

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-2022164239-A1 PYRAZOLE-CARBOXAMIDE DERIVATIVE COMPOUND AND USE THEREOF 주식회사 파미노젠 2022-08-04 WO disclosed