SCHEMBL7835683

SCHEMBL7835683

N#Cc1c(F)c(F)c(Oc2cc(-n3c(=O)[nH]c(C(F)(F)F)c(N)c3=O)c(F)cc2Cl)c(F)c1F

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BCAT1 P54687 13/20 0.43
BCAT2 O15382 12/20 0.43

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
SCHEMBL7836885 0.77 BCAT1 (0.35) BCAT1BCAT2
SCHEMBL7019541 0.76 BCAT2 (0.40) BCAT1BCAT2
SCHEMBL7834523 0.75 BCAT1 (0.34) BCAT1BCAT2
SCHEMBL7833156 0.72 BCAT1 (0.33) BCAT1BCAT2
SCHEMBL8613160 0.72 BCAT2 (0.32) BCAT1BCAT2
SCHEMBL9038745 0.71 BCAT1 (0.34) BCAT1BCAT2
SCHEMBL10530873 0.71 PPOX (0.45) BCAT1BCAT2
SCHEMBL9038251 0.67
SCHEMBL7021357 0.67 BCAT1 (0.69) BCAT1BCAT2
SCHEMBL7740917 0.66 BCAT1 (0.45) BCAT1BCAT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0973395-A4 DIARYL ETHERS AND PROCESSES FOR THEIR PREPARATION AND HERBICIDAL AND DESICCANT COMPOSITIONS CONTAINING THEM ISK AMERICAS INC (US) 2001-10-04 EP disclosed
EP-0973395-A1 DIARYL ETHERS AND PROCESSES FOR THEIR PREPARATION AND HERBICIDAL AND DESICCANT COMPOSITIONS CONTAINING THEM ISK Americas Incorporated (US) 2000-01-26 EP disclosed
WO-1998041093-A1 DIARYL ETHERS AND PROCESSES FOR THEIR PREPARATION AND HERBICIDAL AND DESICCANT COMPOSITIONS CONTAINING THEM ISK AMERICAS INCORPORATED (US) 1998-09-24 WO disclosed