SCHEMBL7795334

SCHEMBL7795334

C=CCC(=O)Oc1nccc(-c2cccc(C(O)C(F)(F)F)c2)n1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMO O15229 5/20 0.36
KDM5B Q9UGL1 1/20 0.35
FGFR3 P22607 1/20 0.33
KDR P35968 1/20 0.33
APP P05067 2/20 0.32
PIK3CA P42336 5/20 0.32
F9 P00740 1/20 0.32
CTSA P10619 2/20 0.31
MEN1 O00255 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL7856804 0.87 CDK8 (0.38) KMOPIK3CA
SCHEMBL7785290 0.84 KDM5B (0.36) KMOKDM5BFGFR3KDRAPP
SCHEMBL7785299 0.78 KMO (0.43) KMOKDM5BAPPF9CTSA
SCHEMBL7791012 0.78 KDM5B (0.37) KMOKDM5BAPP
SCHEMBL7795329 0.72 NTRK1 (0.35)
SCHEMBL7865028 0.70 CDK8 (0.41) KMOPIK3CA
SCHEMBL7793925 0.67 PRKCA (0.32) CTSAHTT
SCHEMBL7795323 0.67 PTGS2 (0.31) MEN1KMT2A
SCHEMBL7795321 0.65 HTT (0.33) HTT
SCHEMBL13188993 0.64 SYK (0.52)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0435632-B1 Phenylpyrimidine derivatives, process for preparing the same, liquid crystal compositions containing said derivatives as active ingredient, and liquid crystal elements using such compositions SUMITOMO CHEMICAL CO (JP) 2001-11-28 EP disclosed
EP-1067122-A2 Phenylpyrimidine derivatives, process for preparing the same, liquid crystal compositions containing said derivatives as active ingredient, and liquid crystal elements using such compositions SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-01-10 EP disclosed
US-5723610-A Alcohol reactants for forming phenylpyrimidine derivatives and process for preparing said alcohols SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-03-03 US disclosed
US-5539115-A FERROELECTRIC CRYSTALS FOR OPTICAL APPARATUS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-07-23 US disclosed
EP-0435632-A2 Phenylpyrimidine derivatives, process for preparing the same, liquid crystal compositions containing said derivatives as active ingredient, and liquid crystal elements using such compositions SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-07-03 EP disclosed