SCHEMBL7788694

SCHEMBL7788694

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

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.49
NPC1 O15118 5/20 0.48
RAB9A P51151 4/20 0.48
TP53 P04637 1/20 0.48
SMN1; SMN2 Q16637 4/20 0.46
ALDH1A1 P00352 4/20 0.46
MAPT P10636 3/20 0.46
LMNA P02545 2/20 0.46
HPGD P15428 2/20 0.46
POLB P06746 2/20 0.42
USP2 O75604 1/20 0.42
CACNA1B Q00975 1/20 0.42
APBA1 Q02410 1/20 0.42
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 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
SCHEMBL7788691 1.00 GAA (0.49) GAANPC1RAB9ATP53SMN1; SMN2
SCHEMBL7783586 0.88 GAA (0.58) GAANPC1RAB9ATP53SMN1; SMN2
SCHEMBL7783588 0.88 GAA (0.58) GAANPC1RAB9ATP53SMN1; SMN2
SCHEMBL7788183 0.88 GAA (0.47) GAANPC1RAB9ATP53SMN1; SMN2
SCHEMBL7788187 0.88 GAA (0.47) GAANPC1RAB9ATP53SMN1; SMN2
SCHEMBL7929787 0.87 ALDH1A1 (0.50) NPC1RAB9ATP53SMN1; SMN2ALDH1A1
SCHEMBL7792349 0.85 GRIN2D (0.51) GAANPC1RAB9ATP53SMN1; SMN2
SCHEMBL7792346 0.85 GRIN2D (0.51) GAANPC1RAB9ATP53SMN1; SMN2
SCHEMBL7791497 0.84 THRB (0.48) GAANPC1RAB9ATP53SMN1; SMN2
SCHEMBL7791498 0.84 THRB (0.48) GAANPC1RAB9ATP53SMN1; SMN2

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