SCHEMBL23398041

SCHEMBL23398041

CCSc1ccc(N(C)C(=O)N(C)C)nc1-c1nc2cc(C(F)(F)F)nnc2n1C

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30

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
SCHEMBL21999928 0.84 DDR1 (0.32) —
SCHEMBL23398105 0.82 — —
SCHEMBL18498705 0.81 POLB (0.33) POLBALDH1A1KDM4E
SCHEMBL21930788 0.81 ALDH1A1 (0.31) ALDH1A1
SCHEMBL18498642 0.81 CYP11B1 (0.35) ALDH1A1
SCHEMBL29720376 0.81 ALDH1A1 (0.31) ALDH1A1
SCHEMBL28359602 0.79 ACVR1 (0.31) POLBALDH1A1
SCHEMBL29720572 0.79 ACVR1 (0.31) POLBALDH1A1
SCHEMBL24067289 0.79 — —
SCHEMBL21999181 0.78 CNR2 (0.31) —

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
EP-3619212-B1 2- (HET) ARYL-SUBSTITUTED CONDENSED HETEROCYCLE DERIVATIVES AS PESTICIDES BAYER AG (DE) 2021-05-26 — — EP disclosed
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