SCHEMBL7791384

SCHEMBL7791384

CCc1ccc(C=NN=Cc2ccc(-c3ccc(C)cc3F)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HDAC1 Q13547 4/20 0.39
KDM1A O60341 3/20 0.39
HDAC6 Q9UBN7 2/20 0.39
ALOX5 P09917 1/20 0.37
PTGS1 P23219 1/20 0.37
PTGS2 P35354 1/20 0.37
CASP3 P42574 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
MAOA P21397 1/20 0.35
RARB P10826 1/20 0.34
NFE2L2 Q16236 1/20 0.34
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC11 Q96DB2 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
SCHEMBL7789206 0.93 NPC1 (0.46) NPC1RAB9ASMN1; SMN2HDAC1KDM1A
SCHEMBL7792424 0.93 NPC1 (0.46) NPC1RAB9ASMN1; SMN2HDAC1KDM1A
SCHEMBL7793273 0.92 NPC1 (0.47) NPC1RAB9ASMN1; SMN2HDAC1KDM1A
SCHEMBL7791283 0.90 CHKA (0.37) NPC1RAB9ASMN1; SMN2ALOX5PTGS1
SCHEMBL7791154 0.90 MAOA (0.37) NPC1RAB9ASMN1; SMN2ALOX5PTGS1
SCHEMBL7788312 0.89 NPC1 (0.41) NPC1RAB9ASMN1; SMN2HDAC1KDM1A
SCHEMBL7791196 0.88 NPC1 (0.57) NPC1RAB9ASMN1; SMN2HDAC1KDM1A
SCHEMBL17615936 0.87 RARB (0.41) HDAC1KDM1APTGS1PTGS2RARB
SCHEMBL7791151 0.85 NPC1 (0.48) NPC1RAB9ASMN1; SMN2HDAC1KDM1A
SCHEMBL15854988 0.85 RARB (0.40) NPC1RAB9AHDAC1KDM1APTGS1

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