SCHEMBL7791429

SCHEMBL7791429

C=CCc1ccc(/C=N/N=C/c2ccc(C)cc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.63
NPC1 O15118 3/20 0.63
RAB9A P51151 2/20 0.63
GRIN2D O15399 2/20 0.46
GRIN3B O60391 2/20 0.46
GRIN1 Q05586 2/20 0.46
GRIN2A Q12879 2/20 0.46
GRIN2B Q13224 2/20 0.46
GRIN2C Q14957 2/20 0.46
GRIN3A Q8TCU5 2/20 0.46
ALDH1A1 P00352 5/20 0.44
TP53 P04637 1/20 0.44
CYP3A4 P08684 1/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
ALOX12 P18054 1/20 0.44
CNR2 P34972 2/20 0.42
CASP3 P42574 2/20 0.41
SENP8 Q96LD8 2/20 0.41
SENP7 Q9BQF6 2/20 0.41

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
SCHEMBL7791430 1.00 SMN1; SMN2 (0.63) SMN1; SMN2NPC1RAB9AGRIN2DGRIN3B
SCHEMBL7791828 0.90 ALDH1A1 (0.47) SMN1; SMN2NPC1RAB9AGRIN2DGRIN3B
SCHEMBL7791826 0.90 ALDH1A1 (0.47) SMN1; SMN2NPC1RAB9AGRIN2DGRIN3B
SCHEMBL7793218 0.85 ALDH1A1 (0.44) SMN1; SMN2NPC1RAB9AGRIN2DGRIN3B
SCHEMBL7793221 0.85 ALDH1A1 (0.44) SMN1; SMN2NPC1RAB9AGRIN2DGRIN3B
SCHEMBL7789117 0.85 NPC1 (0.44) SMN1; SMN2NPC1RAB9AGRIN2DGRIN3B
SCHEMBL7789114 0.85 NPC1 (0.44) SMN1; SMN2NPC1RAB9AGRIN2DGRIN3B
SCHEMBL87997 0.84 ALDH1A1 (0.58) SMN1; SMN2ALDH1A1TP53CYP3A4ALOX15
SCHEMBL7788629 0.82 NPC1 (0.59) SMN1; SMN2NPC1RAB9AGRIN2DGRIN3B
SCHEMBL7788626 0.82 NPC1 (0.59) SMN1; SMN2NPC1RAB9AGRIN2DGRIN3B

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