SCHEMBL7792580

SCHEMBL7792580

COc1ccc(/C=N/N=C/c2ccc(F)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 5/20 0.68
GRIN2D O15399 4/20 0.58
GRIN3B O60391 4/20 0.58
GRIN1 Q05586 4/20 0.58
GRIN2A Q12879 4/20 0.58
GRIN2B Q13224 4/20 0.58
GRIN2C Q14957 4/20 0.58
GRIN3A Q8TCU5 4/20 0.58
NQO2 P16083 1/20 0.52
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
CHRM5 P08912 1/20 0.48
RRM1 P23921 1/20 0.48
RELA Q04206 1/20 0.47
S100B P04271 1/20 0.47

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
SCHEMBL7792584 1.00 NFE2L2 (0.68) NFE2L2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL11776228 0.89 GRIN2D (0.68) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL269159 0.89 GRIN2D (0.68) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL7788556 0.85 AMY1A (0.54) NFE2L2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7788559 0.85 AMY1A (0.54) NFE2L2GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL2904627 0.83 S100B (0.70) NFE2L2NQO2MEN1KMT2AS100B
SCHEMBL2904629 0.83 S100B (0.70) NFE2L2NQO2MEN1KMT2AS100B
SCHEMBL5437012 0.83 S100B (0.70) NFE2L2NQO2MEN1KMT2AS100B
SCHEMBL5437008 0.83 S100B (0.70) NFE2L2NQO2MEN1KMT2AS100B
SCHEMBL7788411 0.83 NQO2 (0.51) NFE2L2GRIN2DGRIN3BGRIN1GRIN2A

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 1 patent. 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