SCHEMBL7783385

SCHEMBL7783385

C=CCCCc1ccc(/C=N/N=C/c2ccc(C)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
RAB9A P51151 2/20 0.55
GRIN2D O15399 3/20 0.43
GRIN3B O60391 3/20 0.43
GRIN1 Q05586 3/20 0.43
GRIN2A Q12879 3/20 0.43
GRIN2B Q13224 3/20 0.43
GRIN2C Q14957 3/20 0.43
GRIN3A Q8TCU5 3/20 0.43
CASP3 P42574 2/20 0.41
SENP8 Q96LD8 2/20 0.41
SENP7 Q9BQF6 2/20 0.41
SENP6 Q9GZR1 2/20 0.41
ALDH1A1 P00352 2/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
MAPK1 P28482 1/20 0.37

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
SCHEMBL7783388 1.00 NPC1 (0.55) NPC1SMN1; SMN2RAB9AGRIN2DGRIN3B
SCHEMBL7793576 0.95 NPC1 (0.53) NPC1SMN1; SMN2RAB9AGRIN2DGRIN3B
SCHEMBL7793574 0.95 NPC1 (0.53) NPC1SMN1; SMN2RAB9AGRIN2DGRIN3B
SCHEMBL7792198 0.92 GRIN1 (0.45) NPC1SMN1; SMN2RAB9AGRIN2DGRIN3B
SCHEMBL7792195 0.92 GRIN1 (0.45) NPC1SMN1; SMN2RAB9AGRIN2DGRIN3B
SCHEMBL7788626 0.90 NPC1 (0.59) NPC1SMN1; SMN2RAB9AGRIN2DGRIN3B
SCHEMBL7788629 0.90 NPC1 (0.59) NPC1SMN1; SMN2RAB9AGRIN2DGRIN3B
SCHEMBL7792160 0.87 GRIN2D (0.47) NPC1SMN1; SMN2RAB9AGRIN2DGRIN3B
SCHEMBL7793272 0.87 GRIN2D (0.50) NPC1SMN1; SMN2RAB9AGRIN2DGRIN3B
SCHEMBL7788703 0.87 GRIN2D (0.57) NPC1SMN1; SMN2RAB9AGRIN2DGRIN3B

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