SCHEMBL3248252

SCHEMBL3248252

CC(=O)OOc1ccccc1Oc1cc(-n2c(=O)cc(C(F)(F)F)n(C)c2=O)c(F)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BCAT1 P54687 14/20 0.39
BCAT2 O15382 12/20 0.39
DHODH Q02127 6/20 0.32

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
SCHEMBL3248258 0.91 BCAT1 (0.40) BCAT1BCAT2DHODH
SCHEMBL29005880 0.89 BCAT1 (0.38) BCAT1BCAT2DHODH
SCHEMBL3247630 0.88 BCAT1 (0.34) BCAT1BCAT2DHODH
SCHEMBL29005679 0.87 BCAT1 (0.51) BCAT1BCAT2
SCHEMBL27044947 0.86 BCAT1 (0.39) BCAT1BCAT2DHODH
SCHEMBL7644653 0.86 BCAT1 (0.36) BCAT1BCAT2
SCHEMBL1527284 0.86 BCAT1 (0.42) BCAT1BCAT2DHODH
SCHEMBL27044951 0.86 BCAT1 (0.38) BCAT1BCAT2DHODH
SCHEMBL29452779 0.85 BCAT1 (0.39) BCAT1BCAT2
SCHEMBL7044781 0.85 BCAT1 (0.39) 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
CN-115996638-A Substituted N-phenyluracils and salts thereof and their use as herbicidal agents 拜耳股份有限公司 2023-04-21 CN disclosed
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