SCHEMBL2623686

SCHEMBL2623686

CC(C)(C)c1nn(-c2ccccc2)c(N)c1/N=N/c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 12/20 0.51
NPC1 O15118 11/20 0.51
RAB9A P51151 11/20 0.51
MAPT P10636 10/20 0.51
TDP1 Q9NUW8 5/20 0.51
ALDH1A1 P00352 4/20 0.51
HPGD P15428 3/20 0.51
LMNA P02545 5/20 0.51
NFKB1 P19838 4/20 0.51
NFKB2 Q00653 4/20 0.51
RELA Q04206 4/20 0.51
PLA2G1B P04054 2/20 0.50
ATG4B Q9Y4P1 2/20 0.50
MAPK1 P28482 4/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
ALOX12 P18054 1/20 0.49
HTT P42858 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
CCNE1 P24864 2/20 0.44

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
SCHEMBL91890 1.00 SMN1; SMN2 (0.51) SMN1; SMN2NPC1RAB9AMAPTTDP1
SCHEMBL92457 0.89 ALOX5 (0.52) SMN1; SMN2NPC1RAB9AMAPTTDP1
SCHEMBL14198820 0.85 SMN1; SMN2 (0.72) SMN1; SMN2NPC1RAB9AMAPTTDP1
SCHEMBL12636703 0.83 ALDH1A1 (0.44) SMN1; SMN2NPC1RAB9AMAPTTDP1
SCHEMBL92445 0.82 CCNE1 (0.48) SMN1; SMN2NPC1RAB9AMAPTTDP1
SCHEMBL92444 0.82 MAPT (0.51) SMN1; SMN2NPC1RAB9AMAPTALDH1A1
SCHEMBL92469 0.81 MEN1 (0.45) SMN1; SMN2NPC1RAB9AMAPTTDP1
SCHEMBL14280348 0.80 CCNE1 (0.45) NPC1RAB9AMAPTTDP1ALDH1A1
SCHEMBL14280341 0.78 CCNE1 (0.44) SMN1; SMN2NPC1RAB9AMAPTTDP1
SCHEMBL14280344 0.77 CCNE1 (0.43) SMN1; SMN2NPC1RAB9AMAPTTDP1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8158317-B2 Color reproducibility, image storability FUJIFILM CORPORATION (JP) 2012-04-17 US disclosed
US-8158317-B2 Color reproducibility, image storability FUJIFILM CORPORATION (JP) 2012-04-17 US disclosed
US-7947625-B2 Ink sheet for heat-sensitive transfer recording material, heat-sensitive transfer recording method, ink cartridge and azo dye FUJIFILM CORPORATION (JP) 2011-05-24 US disclosed
US-20080081269-A1 AZO DYE COMPOUND, COLORING COMPOSITION, INK SHEET FOR THERMAL TRANSFER RECORDING, THERMAL TRANSFER RECORDING METHOD, COLOR TONER, INK FOR INKJET, AND COLOR FILTER FUJIFILM CORPORATION (JP) 2008-04-03 US disclosed
US-20080081269-A1 AZO DYE COMPOUND, COLORING COMPOSITION, INK SHEET FOR THERMAL TRANSFER RECORDING, THERMAL TRANSFER RECORDING METHOD, COLOR TONER, INK FOR INKJET, AND COLOR FILTER FUJIFILM CORPORATION (JP) 2008-04-03 US disclosed
US-20080012929-A1 AZO DYE, HEAT-SENSITIVE TRANSFER RECORDING INK SHEET, HEAT-SENSITIVE TRANSFER RECORDING METHOD, COLOR TONER, INKJET INK AND COLOR FILTER FUJIFILM CORPORATION (JP) 2008-01-17 US disclosed
US-20070202282-A1 Ink sheet for heat-sensitive transfer recording material, heat-sensitive transfer recording method, ink cartridge and azo dye FUJIFILM CORPORATION (JP) 2007-08-30 US disclosed