SCHEMBL7789279

SCHEMBL7789279

CCCc1ccc(/C=N/N=C/c2ccc(C)cc2)cc1F

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.52
RAB9A P51151 3/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
NFE2L2 Q16236 5/20 0.40
GRIN2D O15399 3/20 0.39
GRIN3B O60391 3/20 0.39
GRIN1 Q05586 3/20 0.39
GRIN2A Q12879 3/20 0.39
GRIN2B Q13224 3/20 0.39
GRIN2C Q14957 3/20 0.39
GRIN3A Q8TCU5 3/20 0.39
CASP3 P42574 2/20 0.39
SENP8 Q96LD8 2/20 0.39
SENP7 Q9BQF6 2/20 0.39
SENP6 Q9GZR1 2/20 0.39
BLM P54132 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
PKM P14618 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
SCHEMBL7789282 1.00 NPC1 (0.52) NPC1RAB9ASMN1; SMN2NFE2L2GRIN2D
SCHEMBL7788425 0.88 GRIN2D (0.41) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7788429 0.88 GRIN2D (0.41) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7791392 0.88 NPC1 (0.55) NPC1RAB9ASMN1; SMN2NFE2L2GRIN2D
SCHEMBL7791389 0.88 NPC1 (0.55) NPC1RAB9ASMN1; SMN2NFE2L2GRIN2D
SCHEMBL7783503 0.87 GRIN2D (0.38) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7783504 0.87 GRIN2D (0.38) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7788547 0.85 GRIN2D (0.44) NPC1RAB9ASMN1; SMN2NFE2L2GRIN2D
SCHEMBL7788549 0.85 GRIN2D (0.44) NPC1RAB9ASMN1; SMN2NFE2L2GRIN2D
SCHEMBL7788972 0.84 GRIN2D (0.51) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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