SCHEMBL7788710

SCHEMBL7788710

COc1ccc(C=NN=Cc2ccc(C)cc2)c(F)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AMY1A P0DUB6 1/20 0.52
NPC1 O15118 3/20 0.52
RAB9A P51151 2/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
CYP1A1 P04798 2/20 0.51
CYP1A2 P05177 2/20 0.51
CYP1B1 Q16678 2/20 0.51
CHRM5 P08912 1/20 0.46
RELA Q04206 1/20 0.46
ALDH1A1 P00352 1/20 0.44
GRIN2D O15399 5/20 0.43
GRIN3B O60391 5/20 0.43
GRIN1 Q05586 5/20 0.43
GRIN2A Q12879 5/20 0.43
GRIN2B Q13224 5/20 0.43
GRIN2C Q14957 5/20 0.43
GRIN3A Q8TCU5 5/20 0.43
NFE2L2 Q16236 4/20 0.43
KMT2A Q03164 2/20 0.43
NQO2 P16083 1/20 0.43

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
SCHEMBL7788708 1.00 AMY1A (0.52) AMY1ANPC1RAB9ASMN1; SMN2CYP1A1
SCHEMBL7791874 0.92 AMY1A (0.56) AMY1ANPC1CYP1A1CYP1A2CYP1B1
SCHEMBL7791870 0.92 AMY1A (0.56) AMY1ANPC1CYP1A1CYP1A2CYP1B1
SCHEMBL7793393 0.91 RELA (0.50) AMY1ANPC1RAB9ASMN1; SMN2CYP1A1
SCHEMBL7793389 0.91 RELA (0.50) AMY1ANPC1RAB9ASMN1; SMN2CYP1A1
SCHEMBL7788559 0.89 AMY1A (0.54) AMY1ANPC1CYP1A1CYP1A2CYP1B1
SCHEMBL7788556 0.89 AMY1A (0.54) AMY1ANPC1CYP1A1CYP1A2CYP1B1
SCHEMBL7783577 0.87 AMY1A (0.51) AMY1ANPC1CYP1A1CYP1A2CYP1B1
SCHEMBL7783580 0.87 AMY1A (0.51) AMY1ANPC1CYP1A1CYP1A2CYP1B1
SCHEMBL7789082 0.85 AMY1A (0.52) AMY1ACYP1A1CYP1A2CYP1B1CHRM5

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