SCHEMBL7792609

SCHEMBL7792609

C=CCOc1ccc(C=NN=Cc2ccc(C)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.57
RAB9A P51151 5/20 0.57
SMN1; SMN2 Q16637 4/20 0.57
GAA P10253 2/20 0.51
TP53 P04637 1/20 0.50
CASP3 P42574 1/20 0.49
SENP8 Q96LD8 1/20 0.49
SENP7 Q9BQF6 1/20 0.49
SENP6 Q9GZR1 1/20 0.49
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
GRIN2D O15399 2/20 0.42
GRIN3B O60391 2/20 0.42
GRIN1 Q05586 2/20 0.42
GRIN2A Q12879 2/20 0.42
GRIN2B Q13224 2/20 0.42
GRIN2C Q14957 2/20 0.42

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
SCHEMBL7792604 1.00 NPC1 (0.57) NPC1RAB9ASMN1; SMN2GAATP53
SCHEMBL7783588 0.91 GAA (0.58) NPC1RAB9ASMN1; SMN2GAATP53
SCHEMBL7783586 0.91 GAA (0.58) NPC1RAB9ASMN1; SMN2GAATP53
SCHEMBL7793048 0.87 GAA (0.51) NPC1RAB9ASMN1; SMN2GAATP53
SCHEMBL7793050 0.87 GAA (0.51) NPC1RAB9ASMN1; SMN2GAATP53
SCHEMBL7791897 0.86 GAA (0.43) NPC1RAB9ASMN1; SMN2GAATP53
SCHEMBL7791900 0.86 GAA (0.43) NPC1RAB9ASMN1; SMN2GAATP53
SCHEMBL472078 0.86 CA12 (0.53) NPC1RAB9ASMN1; SMN2GAATP53
SCHEMBL7788691 0.84 GAA (0.49) NPC1RAB9ASMN1; SMN2GAATP53
SCHEMBL7788694 0.84 GAA (0.49) NPC1RAB9ASMN1; SMN2GAATP53

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