SCHEMBL7783266

SCHEMBL7783266

CCCCc1cc(F)c(/C=N/N=C/c2ccc(C)cc2)c(F)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.47
RAB9A P51151 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
GRIN2D O15399 3/20 0.45
GRIN3B O60391 3/20 0.45
GRIN1 Q05586 3/20 0.45
GRIN2A Q12879 3/20 0.45
GRIN2B Q13224 3/20 0.45
GRIN2C Q14957 3/20 0.45
GRIN3A Q8TCU5 3/20 0.45
RRM1 P23921 1/20 0.37
MAPK1 P28482 2/20 0.35
HPGD P15428 1/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
NFE2L2 Q16236 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34

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
SCHEMBL7783270 1.00 NPC1 (0.47) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7791877 0.96 NPC1 (0.46) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7791875 0.96 NPC1 (0.46) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7789231 0.95 NPC1 (0.45) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7789233 0.95 NPC1 (0.45) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7788722 0.92 NPC1 (0.50) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7788723 0.92 NPC1 (0.50) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7791236 0.90 GRIN2D (0.46) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7791233 0.90 GRIN2D (0.46) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7788179 0.89 GRIN2D (0.48) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B

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