SCHEMBL23398053

SCHEMBL23398053

CC[S+]([O-])c1ccc(NC(=O)NC)nc1-c1nc2cc(C(F)(F)F)nnc2n1C

nearest known ligand 0.30

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ACVR1 Q04771 2/20 0.30
▸ CLK4 Q9HAZ1 2/20 0.30
▸ GSK3A P49840 1/20 0.30
▸ GSK3B P49841 1/20 0.30
▸ MST1R Q04912 1/20 0.30
▸ TYRO3 Q06418 1/20 0.30
▸ KIT P10721 1/20 0.30
▸ CDK8 P49336 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
SCHEMBL23398040 0.93 — —
SCHEMBL23398096 0.90 PRKD3 (0.31) ACVR1CLK4MST1RCDK8
SCHEMBL23398069 0.89 — —
SCHEMBL20465937 0.86 CYP2C9 (0.31) ACVR1CLK4GSK3AGSK3BMST1R
SCHEMBL20465928 0.85 CYP2C9 (0.31) —
SCHEMBL23398051 0.84 — —
SCHEMBL23398054 0.83 — —
SCHEMBL20465927 0.83 EIF4EBP1 (0.30) —
SCHEMBL28359602 0.82 ACVR1 (0.31) ACVR1CLK4GSK3AGSK3BMST1R
SCHEMBL21796218 0.82 DDR1 (0.33) ACVR1CLK4GSK3AGSK3BMST1R

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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