SCHEMBL7783486

SCHEMBL7783486

CCCc1ccc(/C=N/N=C/c2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.46
GRIN1 Q05586 2/20 0.44
GRIN2B Q13224 2/20 0.44
GRIN2D O15399 1/20 0.44
GRIN3B O60391 1/20 0.44
GRIN2A Q12879 1/20 0.44
GRIN2C Q14957 1/20 0.44
GRIN3A Q8TCU5 1/20 0.44
MIF P14174 1/20 0.42
MAOB P27338 1/20 0.41
LMNA P02545 3/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
DAO P14920 1/20 0.38
PLK1 P53350 1/20 0.38
BCHE P06276 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
SCHEMBL7783487 1.00 TAAR1 (0.46) TAAR1GRIN1GRIN2BGRIN2DGRIN3B
SCHEMBL7792626 0.90 GRIN2D (0.56) TAAR1GRIN1GRIN2BGRIN2DGRIN3B
SCHEMBL7792630 0.90 GRIN2D (0.56) TAAR1GRIN1GRIN2BGRIN2DGRIN3B
SCHEMBL7791264 0.89 GRIN2D (0.51) TAAR1GRIN1GRIN2BGRIN2DGRIN3B
SCHEMBL7791261 0.89 GRIN2D (0.51) TAAR1GRIN1GRIN2BGRIN2DGRIN3B
SCHEMBL7788701 0.88 GRIN2D (0.50) TAAR1GRIN1GRIN2BGRIN2DGRIN3B
SCHEMBL7788705 0.88 GRIN2D (0.50) TAAR1GRIN1GRIN2BGRIN2DGRIN3B
SCHEMBL7791265 0.86 LMNA (0.41) TAAR1GRIN1GRIN2BLMNAALDH1A1
SCHEMBL7791260 0.86 LMNA (0.41) TAAR1GRIN1GRIN2BLMNAALDH1A1
SCHEMBL7793578 0.86 TAAR1 (0.37) TAAR1GRIN1GRIN2BGRIN2DGRIN3B

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 2 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
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