SCHEMBL7791389

SCHEMBL7791389

CCc1ccc(/C=N/N=C/c2ccc(C)cc2)cc1F

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.55
RAB9A P51151 4/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
NFE2L2 Q16236 4/20 0.42
GRIN2D O15399 2/20 0.41
GRIN3B O60391 2/20 0.41
GRIN1 Q05586 2/20 0.41
GRIN2A Q12879 2/20 0.41
GRIN2B Q13224 2/20 0.41
GRIN2C Q14957 2/20 0.41
GRIN3A Q8TCU5 2/20 0.41
CASP3 P42574 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
BLM P54132 2/20 0.37
PKM P14618 2/20 0.37
CYP1A2 P05177 2/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 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
SCHEMBL7791392 1.00 NPC1 (0.55) NPC1RAB9ASMN1; SMN2NFE2L2GRIN2D
SCHEMBL7789279 0.88 NPC1 (0.52) NPC1RAB9ASMN1; SMN2NFE2L2GRIN2D
SCHEMBL7789282 0.88 NPC1 (0.52) NPC1RAB9ASMN1; SMN2NFE2L2GRIN2D
SCHEMBL7793418 0.87 NPC1 (0.40) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7793414 0.87 NPC1 (0.40) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7789288 0.83 MIF (0.47) NPC1RAB9ASMN1; SMN2NFE2L2GRIN2D
SCHEMBL7789289 0.83 MIF (0.47) NPC1RAB9ASMN1; SMN2NFE2L2GRIN2D
SCHEMBL7789294 0.83 GRIN2D (0.40) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7789297 0.83 GRIN2D (0.40) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7789167 0.82 NPC1 (0.57) NPC1RAB9ASMN1; SMN2NFE2L2GRIN2D

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