SCHEMBL7783366

SCHEMBL7783366

COc1c(F)cc(C=NN=Cc2ccc(C)cc2)cc1F

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.57
RAB9A P51151 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
TUBB1 Q9H4B7 6/20 0.44
TUBB4A P04350 1/20 0.44
TUBB P07437 1/20 0.44
TUBA3C P0DPH7 1/20 0.44
TUBA1B P68363 1/20 0.44
TUBA4A P68366 1/20 0.44
TUBB4B P68371 1/20 0.44
TUBB3 Q13509 1/20 0.44
TUBB2A Q13885 1/20 0.44
TUBB8 Q3ZCM7 1/20 0.44
TUBA3E Q6PEY2 1/20 0.44
TUBA1A Q71U36 1/20 0.44
TUBA1C Q9BQE3 1/20 0.44
TUBB6 Q9BUF5 1/20 0.44
TUBB2B Q9BVA1 1/20 0.44
NFE2L2 Q16236 3/20 0.43
GRIN2D O15399 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
SCHEMBL7783362 1.00 NPC1 (0.57) NPC1RAB9ASMN1; SMN2TUBB1TUBB4A
SCHEMBL7788650 0.87 GRIN2D (0.50) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL7788649 0.87 GRIN2D (0.50) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL7792278 0.86 NPC1 (0.52) NPC1RAB9ASMN1; SMN2TUBB1TUBB4A
SCHEMBL7792274 0.86 NPC1 (0.52) NPC1RAB9ASMN1; SMN2TUBB1TUBB4A
SCHEMBL7792437 0.83 TUBB1 (0.48) NPC1RAB9ASMN1; SMN2TUBB1ALDH1A1
SCHEMBL7793484 0.83 NPC1 (0.52) NPC1RAB9ASMN1; SMN2NFE2L2GRIN2D
SCHEMBL7793485 0.83 NPC1 (0.52) NPC1RAB9ASMN1; SMN2NFE2L2GRIN2D
SCHEMBL7792440 0.83 TUBB1 (0.48) NPC1RAB9ASMN1; SMN2TUBB1ALDH1A1
SCHEMBL7792161 0.82 NPC1 (0.65) NPC1RAB9ASMN1; SMN2TUBB1NFE2L2

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