SCHEMBL7793050

SCHEMBL7793050

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

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.51
ALDH1A1 P00352 3/20 0.50
TP53 P04637 3/20 0.50
GRIN2D O15399 2/20 0.50
GRIN3B O60391 2/20 0.50
GRIN1 Q05586 2/20 0.50
GRIN2A Q12879 2/20 0.50
GRIN2B Q13224 2/20 0.50
GRIN2C Q14957 2/20 0.50
GRIN3A Q8TCU5 2/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
MAPT P10636 1/20 0.50
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
FLT3 P36888 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.44
CYP3A4 P08684 1/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44

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
SCHEMBL7793048 1.00 GAA (0.51) GAAALDH1A1TP53GRIN2DGRIN3B
SCHEMBL7783586 0.91 GAA (0.58) GAAALDH1A1TP53NPC1RAB9A
SCHEMBL7783588 0.91 GAA (0.58) GAAALDH1A1TP53NPC1RAB9A
SCHEMBL7792609 0.87 NPC1 (0.57) GAAALDH1A1TP53GRIN2DGRIN3B
SCHEMBL7792604 0.87 NPC1 (0.57) GAAALDH1A1TP53GRIN2DGRIN3B
1-Allyloxy-4-Methoxybenzene SCHEMBL2843640 0.86 ALDH1A1 (0.57) GAAALDH1A1TP53NPC1RAB9A
SCHEMBL1232260 0.84 TP53 (0.50) GAAALDH1A1TP53NPC1RAB9A
SCHEMBL7788694 0.84 GAA (0.49) GAAALDH1A1TP53NPC1RAB9A
SCHEMBL7788691 0.84 GAA (0.49) GAAALDH1A1TP53NPC1RAB9A
SCHEMBL7792215 0.83 GAA (0.51) GAAALDH1A1TP53GRIN2DGRIN3B

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