SCHEMBL7791155

SCHEMBL7791155

CCCc1cc(F)c(/C=N/N=C/c2ccc(OC)cc2)c(F)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RRM1 P23921 1/20 0.42
GRIN2D O15399 2/20 0.42
GRIN3B O60391 2/20 0.42
GRIN1 Q05586 2/20 0.42
GRIN2A Q12879 2/20 0.42
GRIN2B Q13224 2/20 0.42
GRIN2C Q14957 2/20 0.42
GRIN3A Q8TCU5 2/20 0.42
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
CHRM5 P08912 1/20 0.39
MAPT P10636 1/20 0.39
G6PC1 P35575 1/20 0.38
NFE2L2 Q16236 4/20 0.37
CYP3A4 P08684 2/20 0.37
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL7791161 1.00 RRM1 (0.42) RRM1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7788496 0.92 GRIN2D (0.42) RRM1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7788500 0.92 GRIN2D (0.42) RRM1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7793426 0.91 PTGS2 (0.42) RRM1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7793431 0.91 PTGS2 (0.42) RRM1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7789058 0.90 PTGS2 (0.41) RRM1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7789056 0.90 PTGS2 (0.41) RRM1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7788919 0.89 CA12 (0.39) RRM1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7788922 0.89 CA12 (0.39) RRM1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7791487 0.89 GRIN2D (0.44) RRM1GRIN2DGRIN3BGRIN1GRIN2A

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-0825176-B1 Azine derivative, process for the preparation thereof, nematic liquid crystal composition and liquid crystal display system comprising same DAINIPPON INK & CHEMICALS (JP) 2001-11-14 EP disclosed
US-6010642-A LIGHT SCATTERING LIQUID CRYSTAL DISPLAY DAINIPPON INK AND CHEMICALS, INC. (JP) 2000-01-04 US disclosed
EP-0825176-A1 Azine derivative, process for the preparation thereof, nematic liquid crystal composition and liquid crystal display system comprising same DAINIPPON INK AND CHEMICALS, INC. (JP) 1998-02-25 EP disclosed