SCHEMBL7789203

SCHEMBL7789203

CCCc1ccc(/C=N/N=C/c2ccc(F)c(F)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 2/20 0.43
GRIN2B Q13224 2/20 0.43
GRIN2D O15399 1/20 0.43
GRIN3B O60391 1/20 0.43
GRIN2A Q12879 1/20 0.43
GRIN2C Q14957 1/20 0.43
GRIN3A Q8TCU5 1/20 0.43
TRPA1 O75762 1/20 0.40
NFE2L2 Q16236 2/20 0.39
NPC1 O15118 4/20 0.38
RAB9A P51151 4/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
PKM P14618 2/20 0.38
TP53 P04637 1/20 0.38
HSD17B10 Q99714 1/20 0.38
PLA2G7 Q13093 2/20 0.37
BLM P54132 2/20 0.37
MAPK1 P28482 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 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
SCHEMBL7789207 1.00 GRIN1 (0.43) GRIN1GRIN2BGRIN2DGRIN3BGRIN2A
SCHEMBL7789147 0.91 GRIN1 (0.55) GRIN1GRIN2BGRIN2DGRIN3BGRIN2A
SCHEMBL7789145 0.91 GRIN1 (0.55) GRIN1GRIN2BGRIN2DGRIN3BGRIN2A
SCHEMBL7783432 0.89 GRIN2D (0.50) GRIN1GRIN2BGRIN2DGRIN3BGRIN2A
SCHEMBL7783433 0.89 GRIN2D (0.50) GRIN1GRIN2BGRIN2DGRIN3BGRIN2A
SCHEMBL7788668 0.88 GRIN2D (0.49) GRIN1GRIN2BGRIN2DGRIN3BGRIN2A
SCHEMBL7788671 0.88 GRIN2D (0.49) GRIN1GRIN2BGRIN2DGRIN3BGRIN2A
SCHEMBL7788237 0.88 TRPA1 (0.37) GRIN1GRIN2BGRIN2DGRIN3BGRIN2A
SCHEMBL7788241 0.88 TRPA1 (0.37) GRIN1GRIN2BGRIN2DGRIN3BGRIN2A
SCHEMBL7788574 0.88 GRIN2D (0.41) GRIN1GRIN2BGRIN2DGRIN3BGRIN2A

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
JP-10087594-A None JP disclosed
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
JP-H1087594-A FLUORINE-SUBSTITUTED AZINE DAINIPPON INK & CHEM INC 1998-04-07 JP 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