SCHEMBL8105366

SCHEMBL8105366

CCON=Cc1cc(-n2c(=O)cc(C(F)(F)F)[nH]c2=O)c(F)cc1Cl

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BCAT1 P54687 20/20 0.48
BCAT2 O15382 18/20 0.48

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
SCHEMBL8105362 1.00 BCAT1 (0.48) BCAT1BCAT2
SCHEMBL7164163 0.92 BCAT1 (0.50) BCAT1BCAT2
SCHEMBL7162001 0.89 BCAT1 (0.54) BCAT1BCAT2
SCHEMBL23635703 0.83 BCAT1 (0.48) BCAT1BCAT2
SCHEMBL31580253 0.83 PPOX (0.37) BCAT1BCAT2
SCHEMBL7930259 0.83 BCAT1 (0.44) BCAT1BCAT2
SCHEMBL8112922 0.83 BCAT1 (0.44) BCAT1BCAT2
SCHEMBL23635731 0.82 BCAT1 (0.47) BCAT1BCAT2
SCHEMBL9038251 0.82
SCHEMBL7895897 0.81 BCAT1 (0.52) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0716653-B1 SUBSTITUTED 1-AMINO-3-PHENYLURACILS WITH HERBICIDAL ACTIVITIES BASF AG (DE) 2000-04-26 EP disclosed
US-5700805-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1997-12-23 US disclosed
EP-0716653-A1 SUBSTITUTED 1-AMINO-3-PHENYLURACILS WITH HERBICIDAL ACTIVITIES BASF AKTIENGESELLSCHAFT (DE) 1996-06-19 EP disclosed
WO-1995006641-A1 SUBSTITUTED 1-AMINO-3-PHENYLURACILS WITH HERBICIDAL ACTIVITIES BASF AKTIENGESELLSCHAFT (DE) 1995-03-09 WO disclosed