SCHEMBL8138124

SCHEMBL8138124

CS(=O)(=O)Nc1cc(-n2c(=O)cc(C(F)(F)F)n3ccnc23)c(F)cc1C#N

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BCAT2 O15382 7/20 0.33
BCAT1 P54687 7/20 0.33
PTK2 Q05397 2/20 0.31
SCN9A Q15858 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
SCHEMBL7901513 0.86 PPOX (0.36)
SCHEMBL8137605 0.86
SCHEMBL8925239 0.82 BCAT2 (0.35) BCAT2BCAT1
SCHEMBL8140021 0.81 BCAT2 (0.35) BCAT2BCAT1
SCHEMBL8134058 0.81 BCAT2 (0.35) BCAT2BCAT1
SCHEMBL8323113 0.81 PGR (0.35) BCAT2BCAT1
SCHEMBL8122021 0.77 MCL1 (0.34)
SCHEMBL8138131 0.76 BCAT2 (0.40) BCAT2BCAT1
SCHEMBL7901426 0.75 MCL1 (0.32)
SCHEMBL8600186 0.75 BCAT2 (0.39) BCAT2BCAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6165942-A Heterocycle-fused pyrimidinone derivative and herbicidal composition NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2000-12-26 US disclosed
EP-0970958-A1 HETEROCYCLE-FUSED PYRIMIDINONE DERIVATIVES AND HERBICIDES NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) 2000-01-12 EP disclosed