SCHEMBL3240485

SCHEMBL3240485

CC(=O)Oc1ccccc1Oc1cc(-n2c(=O)cc(C(F)(F)F)[nH]c2=O)c(F)cc1Cl

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BCAT1 P54687 20/20 0.62
BCAT2 O15382 18/20 0.61

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
SCHEMBL3240477 0.91 BCAT1 (0.60) BCAT1BCAT2
SCHEMBL27495271 0.86 BCAT1 (0.66) BCAT1BCAT2
SCHEMBL7017337 0.85 BCAT1 (0.67) BCAT1BCAT2
SCHEMBL3264126 0.85 BCAT1 (0.60) BCAT1BCAT2
SCHEMBL13842893 0.85 BCAT1 (0.59) BCAT1BCAT2
SCHEMBL7020343 0.84 BCAT1 (0.66) BCAT1BCAT2
SCHEMBL7021038 0.83 BCAT1 (0.73) BCAT1BCAT2
SCHEMBL7019548 0.82 BCAT1 (0.62) BCAT1BCAT2
SCHEMBL7022834 0.82 BCAT1 (0.79) BCAT1BCAT2
SCHEMBL14635743 0.82 BCAT1 (0.57) 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-1736052-B1 Stem/leaf desiccant SUMITOMO CHEMICAL CO (JP) 2010-04-21 EP disclosed
EP-1736052-A2 Stem/leaf desiccant Sumitomo Chemical Company, Limited (JP) 2006-12-27 EP disclosed
WO-2002098227-A1 PLANT GROWTH REGULATORS FOR COTTON HERVEST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-12-12 WO disclosed