SCHEMBL29720376

SCHEMBL29720376

CCSc1ccc(Br)nc1-c1nc2cc(C(F)(F)F)nnc2n1C

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.31

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
SCHEMBL21930788 1.00 ALDH1A1 (0.31) ALDH1A1
SCHEMBL18498642 0.87 CYP11B1 (0.35) ALDH1A1
SCHEMBL24067289 0.85 — —
SCHEMBL17941382 0.84 PDE2A (0.32) —
SCHEMBL29521456 0.83 ALDH1A1 (0.33) ALDH1A1
SCHEMBL20468387 0.83 ALDH1A1 (0.33) ALDH1A1
SCHEMBL23748074 0.83 POLB (0.30) —
SCHEMBL19725900 0.82 PDE10A (0.35) —
SCHEMBL20468523 0.82 DGAT1 (0.31) ALDH1A1
SCHEMBL30177583 0.82 POLB (0.32) —

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
CN-110637019-B 2- (hetero) aryl-substituted fused bicyclic heterocyclic derivatives as pest control agents 拜耳公司 2022-07-12 — — CN disclosed
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