SCHEMBL7793414

SCHEMBL7793414

CCc1ccc(/C=N/N=C/c2ccc(CC)c(F)c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.40
RAB9A P51151 4/20 0.40
GAA P10253 4/20 0.40
PKM P14618 2/20 0.40
MAOA P21397 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.37
BLM P54132 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
MAPK1 P28482 1/20 0.37
THPO P40225 1/20 0.37
CHRM5 P08912 1/20 0.37
GRM5 P41594 1/20 0.37
PMP22 Q01453 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
LMNA P02545 2/20 0.36
ALOX5 P09917 1/20 0.35
PTGS1 P23219 1/20 0.35

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
SCHEMBL7793418 1.00 NPC1 (0.40) NPC1RAB9AGAAPKMMAOA
SCHEMBL7789297 0.89 GRIN2D (0.40) NPC1RAB9AGAAPKMSMN1; SMN2
SCHEMBL7789294 0.89 GRIN2D (0.40) NPC1RAB9AGAAPKMSMN1; SMN2
SCHEMBL7783504 0.89 GRIN2D (0.38) NPC1RAB9AGAAPKMMAOA
SCHEMBL7783503 0.89 GRIN2D (0.38) NPC1RAB9AGAAPKMMAOA
SCHEMBL7791392 0.87 NPC1 (0.55) NPC1RAB9APKMSMN1; SMN2BLM
SCHEMBL7791389 0.87 NPC1 (0.55) NPC1RAB9APKMSMN1; SMN2BLM
SCHEMBL7783401 0.87 GRIN2D (0.51) SMN1; SMN2CYP3A4CYP2D6ALDH1A1HPGD
SCHEMBL7783397 0.87 GRIN2D (0.51) SMN1; SMN2CYP3A4CYP2D6ALDH1A1HPGD
SCHEMBL7793238 0.87 PLA2G7 (0.42) NPC1RAB9AGAAPKMMAOA

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