SCHEMBL7793564

SCHEMBL7793564

C=CCCCCc1ccc(C=NN=Cc2ccc(F)c(F)c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 2/20 0.36
GRIN2B Q13224 2/20 0.36
GRIN2D O15399 1/20 0.36
GRIN3B O60391 1/20 0.36
GRIN2A Q12879 1/20 0.36
GRIN2C Q14957 1/20 0.36
GRIN3A Q8TCU5 1/20 0.36
PLA2G7 Q13093 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MAPK1 P28482 2/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
PKM P14618 1/20 0.33
THPO P40225 1/20 0.33
CHRM5 P08912 1/20 0.33
GRM5 P41594 1/20 0.33
BLM P54132 1/20 0.33

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
SCHEMBL7793560 1.00 GRIN1 (0.36) GRIN1GRIN2BGRIN2DGRIN3BGRIN2A
SCHEMBL7788257 0.96 GRIN1 (0.37) GRIN1GRIN2BGRIN2DGRIN3BGRIN2A
SCHEMBL7788252 0.96 GRIN1 (0.37) GRIN1GRIN2BGRIN2DGRIN3BGRIN2A
SCHEMBL7783445 0.90 PLA2G7 (0.35) GRIN1GRIN2BGRIN2DGRIN3BGRIN2A
SCHEMBL7783442 0.90 PLA2G7 (0.35) GRIN1GRIN2BGRIN2DGRIN3BGRIN2A
SCHEMBL7783387 0.89 GRIN2D (0.36) GRIN1GRIN2BGRIN2DGRIN3BGRIN2A
SCHEMBL7783390 0.89 GRIN2D (0.36) GRIN1GRIN2BGRIN2DGRIN3BGRIN2A
SCHEMBL7789049 0.87 GRIN2D (0.44) GRIN1GRIN2BGRIN2DGRIN3BGRIN2A
SCHEMBL7789052 0.87 GRIN2D (0.44) GRIN1GRIN2BGRIN2DGRIN3BGRIN2A
SCHEMBL7789007 0.85 GRIN2D (0.40) 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 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