SCHEMBL7789160

SCHEMBL7789160

CCc1cc(F)c(C=NN=Cc2ccc(C)cc2)c(F)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.53
RAB9A P51151 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
RRM1 P23921 1/20 0.40
GRIN2D O15399 2/20 0.40
GRIN3B O60391 2/20 0.40
GRIN1 Q05586 2/20 0.40
GRIN2A Q12879 2/20 0.40
GRIN2B Q13224 2/20 0.40
GRIN2C Q14957 2/20 0.40
GRIN3A Q8TCU5 2/20 0.40
NFE2L2 Q16236 5/20 0.38
ALDH1A1 P00352 2/20 0.36
MAPT P10636 1/20 0.36
CASP3 P42574 2/20 0.36
SENP8 Q96LD8 2/20 0.36
SENP7 Q9BQF6 2/20 0.36
SENP6 Q9GZR1 2/20 0.36
CA12 O43570 1/20 0.34
CA1 P00915 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
SCHEMBL7789159 1.00 NPC1 (0.53) NPC1RAB9ASMN1; SMN2RRM1GRIN2D
SCHEMBL7788223 0.90 MAOA (0.40) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7788227 0.90 MAOA (0.40) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7788203 0.89 GRIN2D (0.41) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7788198 0.89 GRIN2D (0.41) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7788722 0.88 NPC1 (0.50) NPC1RAB9ASMN1; SMN2RRM1GRIN2D
SCHEMBL7788723 0.88 NPC1 (0.50) NPC1RAB9ASMN1; SMN2RRM1GRIN2D
SCHEMBL7793373 0.88 NPC1 (0.44) NPC1RAB9ASMN1; SMN2RRM1GRIN2D
SCHEMBL7793377 0.88 NPC1 (0.44) NPC1RAB9ASMN1; SMN2RRM1GRIN2D
SCHEMBL7793629 0.86 MAOB (0.41) 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