SCHEMBL7789229

SCHEMBL7789229

Cc1cc(F)c(C=NN=Cc2ccc(F)cc2)c(F)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.50
RAB9A P51151 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
NFE2L2 Q16236 5/20 0.47
GRIN2D O15399 3/20 0.44
GRIN3B O60391 3/20 0.44
GRIN1 Q05586 3/20 0.44
GRIN2A Q12879 3/20 0.44
GRIN2B Q13224 3/20 0.44
GRIN2C Q14957 3/20 0.44
GRIN3A Q8TCU5 3/20 0.44
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
PKM P14618 1/20 0.40
MAPK1 P28482 1/20 0.40
THPO P40225 1/20 0.40

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
SCHEMBL7789228 1.00 NPC1 (0.50) NPC1RAB9ASMN1; SMN2NFE2L2GRIN2D
SCHEMBL7793263 0.91 NPC1 (0.63) NPC1RAB9ASMN1; SMN2NFE2L2GRIN2D
SCHEMBL7793268 0.91 NPC1 (0.63) NPC1RAB9ASMN1; SMN2NFE2L2GRIN2D
SCHEMBL7783421 0.86 NPC1 (0.47) NPC1RAB9ASMN1; SMN2NFE2L2GRIN2D
SCHEMBL7783424 0.86 NPC1 (0.47) NPC1RAB9ASMN1; SMN2NFE2L2GRIN2D
SCHEMBL7783428 0.84 NFE2L2 (0.53) NPC1RAB9ASMN1; SMN2NFE2L2POLB
SCHEMBL7783430 0.84 NFE2L2 (0.53) NPC1RAB9ASMN1; SMN2NFE2L2POLB
SCHEMBL7793377 0.83 NPC1 (0.44) NPC1RAB9ASMN1; SMN2NFE2L2GRIN2D
SCHEMBL7791889 0.83 GRIN2D (0.47) NPC1RAB9ASMN1; SMN2NFE2L2GRIN2D
SCHEMBL7791884 0.83 GRIN2D (0.47) NPC1RAB9ASMN1; SMN2NFE2L2GRIN2D

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