SCHEMBL7791124

SCHEMBL7791124

COc1ccc(/C=N/N=C/c2ccc(C)cc2)cc1F

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.55
RAB9A P51151 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
MAPT P10636 2/20 0.54
CYP1A2 P05177 1/20 0.54
TUBB1 Q9H4B7 9/20 0.54
GFER P55789 1/20 0.43
TUBB4A P04350 1/20 0.42
TUBB P07437 1/20 0.42
TUBA3C P0DPH7 1/20 0.42
TUBA1B P68363 1/20 0.42
TUBA4A P68366 1/20 0.42
TUBB4B P68371 1/20 0.42
TUBB3 Q13509 1/20 0.42
TUBB2A Q13885 1/20 0.42
TUBB8 Q3ZCM7 1/20 0.42
TUBA3E Q6PEY2 1/20 0.42
TUBA1A Q71U36 1/20 0.42
TUBA1C Q9BQE3 1/20 0.42
TUBB6 Q9BUF5 1/20 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
SCHEMBL7791127 1.00 NPC1 (0.55) NPC1RAB9ASMN1; SMN2MAPTCYP1A2
SCHEMBL12356576 0.88 NPC1 (0.52) NPC1RAB9ASMN1; SMN2MAPTCYP1A2
SCHEMBL7792352 0.87 MAPT (0.54) MAPTCYP1A2TUBB1TUBB4ATUBB
SCHEMBL7792357 0.87 MAPT (0.54) MAPTCYP1A2TUBB1TUBB4ATUBB
SCHEMBL13955777 0.84 TUBB1 (0.51) MAPTTUBB1GFER
SCHEMBL7791200 0.83 MAPT (0.50) NPC1RAB9AMAPTCYP1A2TUBB1
SCHEMBL7791205 0.83 MAPT (0.50) NPC1RAB9AMAPTCYP1A2TUBB1
SCHEMBL7791508 0.83 NPC1 (0.50) NPC1RAB9ASMN1; SMN2MAPTCYP1A2
SCHEMBL7788589 0.83 NPC1 (0.50) NPC1RAB9ASMN1; SMN2MAPTCYP1A2
SCHEMBL7788586 0.83 NPC1 (0.50) NPC1RAB9ASMN1; SMN2MAPTCYP1A2

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