SCHEMBL7791383

SCHEMBL7791383

CCCc1ccc(C=NN=Cc2ccc(-c3ccc(C)cc3)c(F)c2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.44
RAB9A P51151 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
RARB P10826 1/20 0.40
S1PR1 P21453 3/20 0.37
GRIN2D O15399 3/20 0.36
GRIN3B O60391 3/20 0.36
GRIN1 Q05586 3/20 0.36
GRIN2A Q12879 3/20 0.36
GRIN2B Q13224 3/20 0.36
GRIN2C Q14957 3/20 0.36
GRIN3A Q8TCU5 3/20 0.36
BACE1 P56817 1/20 0.35
NFE2L2 Q16236 1/20 0.35
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
TP53 P04637 1/20 0.34
PKM P14618 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
SCHEMBL7788308 1.00 NPC1 (0.44) NPC1RAB9ASMN1; SMN2RARBS1PR1
SCHEMBL7789220 0.95 RARB (0.43) NPC1RAB9ASMN1; SMN2RARBS1PR1
SCHEMBL7791144 0.94 NPC1 (0.45) NPC1RAB9ASMN1; SMN2RARBS1PR1
SCHEMBL7788312 0.94 NPC1 (0.41) NPC1RAB9ASMN1; SMN2RARBS1PR1
SCHEMBL7791259 0.93 RARB (0.46) NPC1RAB9ASMN1; SMN2RARBS1PR1
SCHEMBL7789214 0.91 RARB (0.51) NPC1RAB9ASMN1; SMN2RARBS1PR1
SCHEMBL7789199 0.91 RARB (0.41) NPC1RAB9ASMN1; SMN2RARBS1PR1
SCHEMBL7789265 0.91 RARB (0.41) NPC1RAB9ASMN1; SMN2RARBS1PR1
SCHEMBL7791132 0.90 RARB (0.53) NPC1RAB9ASMN1; SMN2RARBGRIN2D
SCHEMBL7791549 0.90 RARB (0.53) NPC1RAB9ASMN1; SMN2RARBGRIN2D

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