SCHEMBL9468940

SCHEMBL9468940

CCc1cc(=O)n(-c2cc(C(=O)OC(C)C)c(C#N)cc2F)c(=O)n1C

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BCAT2 O15382 7/20 0.35
BCAT1 P54687 7/20 0.35
USP14 P54578 1/20 0.31
DHODH Q02127 3/20 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
SCHEMBL9469402 0.89 L3MBTL1 (0.35) BCAT2BCAT1USP14
SCHEMBL9468862 0.87 BCAT2 (0.35) BCAT2BCAT1USP14
SCHEMBL9468823 0.87 BCAT2 (0.35) BCAT2BCAT1USP14
SCHEMBL9706612 0.85 LMNA (0.35) DHODH
SCHEMBL7960192 0.84 BCAT2 (0.37) BCAT2BCAT1
SCHEMBL9469110 0.83 L3MBTL1 (0.32) BCAT2BCAT1USP14DHODH
SCHEMBL9469091 0.82 L3MBTL1 (0.35) BCAT2BCAT1USP14
SCHEMBL9469357 0.81 BCAT1 (0.42) BCAT2BCAT1USP14
SCHEMBL9587411 0.79 BCAT2 (0.34) BCAT2BCAT1USP14
SCHEMBL9469169 0.79 BCAT2 (0.34) BCAT2BCAT1USP14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5266554-A Herbicides CIBA-GEIGY CORPORATION (US) 1993-11-30 US disclosed