SCHEMBL7789018

SCHEMBL7789018

C=CCCc1ccc(C=NN=Cc2ccc(CCC=C)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
GRIN2D O15399 3/20 0.40
GRIN3B O60391 3/20 0.40
GRIN1 Q05586 3/20 0.40
GRIN2A Q12879 3/20 0.40
GRIN2B Q13224 3/20 0.40
GRIN2C Q14957 3/20 0.40
GRIN3A Q8TCU5 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
LMNA P02545 2/20 0.39
CA1 P00915 3/20 0.35
CA2 P00918 3/20 0.35
CA9 Q16790 2/20 0.35
CA7 P43166 1/20 0.35
F2 P00734 1/20 0.34
FURIN P09958 1/20 0.34

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
SCHEMBL8153254 1.00 NPC1 (0.41) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL7783395 0.91 GRIN2D (0.42) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL8152315 0.91 GRIN2D (0.43) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL8148750 0.91 GRIN2D (0.45) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL7792204 0.91 GRIN2D (0.43) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL7788629 0.91 NPC1 (0.59) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL7792200 0.91 GRIN2D (0.43) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL7783399 0.91 GRIN2D (0.42) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL8148747 0.91 GRIN2D (0.45) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL7788626 0.91 NPC1 (0.59) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT

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