SCHEMBL7789067

SCHEMBL7789067

CCCc1ccc(/C=N/N=C/c2c(F)cc(C)cc2F)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.42
RAB9A P51151 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
GRIN2D O15399 3/20 0.40
GRIN3B O60391 3/20 0.40
GRIN1 Q05586 3/20 0.40
GRIN2A Q12879 3/20 0.40
GRIN2B Q13224 3/20 0.40
GRIN2C Q14957 3/20 0.40
GRIN3A Q8TCU5 3/20 0.40
FFAR4 Q5NUL3 1/20 0.38
CA2 P00918 2/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA9 Q16790 1/20 0.35
ABCB1 P08183 1/20 0.34
CASP3 P42574 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 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
SCHEMBL7789071 1.00 NPC1 (0.42) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7791931 0.91 GRIN2D (0.42) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7791928 0.91 GRIN2D (0.42) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7783227 0.88 GRIN2D (0.40) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7783230 0.88 GRIN2D (0.40) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7788723 0.88 NPC1 (0.50) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7788722 0.88 NPC1 (0.50) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7793377 0.88 NPC1 (0.44) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7793373 0.88 NPC1 (0.44) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL7792483 0.86 GRIN2D (0.51) SMN1; SMN2GRIN2DGRIN3BGRIN1GRIN2A

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