SCHEMBL7833156

SCHEMBL7833156

Nc1c(C(=O)C(F)(F)F)ccnc1Oc1cc(-n2c(=O)[nH]c(C(F)(F)F)c(N)c2=O)c(F)cc1Cl

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BCAT1 P54687 7/20 0.33
BCAT2 O15382 6/20 0.33
MET P08581 1/20 0.32
AXL P30530 1/20 0.32
BRAF P15056 2/20 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
SCHEMBL7013644 0.80 BCAT2 (0.30) BCAT1BCAT2
SCHEMBL7836885 0.78 BCAT1 (0.35) BCAT1BCAT2
SCHEMBL7834523 0.73 BCAT1 (0.34) BCAT1BCAT2
SCHEMBL7835683 0.72 BCAT1 (0.43) BCAT1BCAT2
SCHEMBL8613160 0.70 BCAT2 (0.32) BCAT1BCAT2
SCHEMBL4849488 0.70 PPOX (0.42) BCAT1BCAT2
SCHEMBL9038745 0.70 BCAT1 (0.34) BCAT1BCAT2
SCHEMBL10530873 0.67 PPOX (0.45) BCAT1BCAT2
SCHEMBL7023417 0.66 BCAT1 (0.55) BCAT1BCAT2
SCHEMBL9038251 0.66

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