SCHEMBL7785307

SCHEMBL7785307

C=CCc1ccc(C(O)C(F)(F)F)c(-c2ncccn2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 9/20 0.41
GABRB2 P47870 9/20 0.41
MAPT P10636 5/20 0.41
MEN1 O00255 5/20 0.41
KMT2A Q03164 5/20 0.41
ALDH1A1 P00352 5/20 0.41
CNR2 P34972 5/20 0.41
GAA P10253 4/20 0.41
CNR1 P21554 3/20 0.41
KDM4E B2RXH2 2/20 0.41
PPARG P37231 2/20 0.41
PPARD Q03181 2/20 0.41
ALDH2 P05091 1/20 0.41
AKR1B1 P15121 1/20 0.41
HPGD P15428 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TNKS O95271 1/20 0.36
PARP1 P09874 1/20 0.36
XDH P47989 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.35

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
SCHEMBL7865071 0.83 GABRA1 (0.44) GABRA1GABRB2MAPTMEN1KMT2A
SCHEMBL7785310 0.78 USP1 (0.31)
SCHEMBL7794838 0.76 SNCA (0.42) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL7791009 0.75 NTRK1 (0.35) GABRA1GABRB2MAPTMEN1KMT2A
SCHEMBL10485339 0.75 GABRA1 (0.69) GABRA1GABRB2MAPTMEN1KMT2A
SCHEMBL8517769 0.70 GABRA1 (0.39) GABRA1GABRB2MAPTMEN1KMT2A
SCHEMBL7785288 0.68 GAA (0.35) MAPTMEN1KMT2AALDH1A1GAA
SCHEMBL7793906 0.65 GABRA1 (0.39) GABRA1GABRB2KMT2AALDH1A1KDM4E
SCHEMBL7795329 0.65 NTRK1 (0.35) TRPM8
SCHEMBL10590683 0.64 ADRB2 (0.57) GABRA1GABRB2MAPTMEN1KMT2A

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