SCHEMBL13603898

SCHEMBL13603898

O=C(O)CN(CC(=O)OCc1ccc2ccccc2c1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 1/20 0.47
▸ CA1 P00915 4/20 0.46
▸ CA2 P00918 4/20 0.46
▸ CYP1A2 P05177 1/20 0.43
▸ SLC1A3 P43003 1/20 0.43
▸ SLC1A2 P43004 1/20 0.43
▸ SLC1A1 P43005 1/20 0.43
▸ PPARG P37231 1/20 0.42
▸ KEAP1 Q14145 2/20 0.42
▸ NFE2L2 Q16236 2/20 0.42
▸ NR1H4 Q96RI1 1/20 0.41
▸ CASP1 P29466 2/20 0.41
▸ FNTA P49354 1/20 0.40
▸ FNTB P49356 1/20 0.40
▸ PLA2G4B P0C869 1/20 0.40
▸ SLC6A2 P23975 1/20 0.40
▸ SLC6A4 P31645 1/20 0.40
▸ SLC6A3 Q01959 1/20 0.40
▸ PTGDR2 Q9Y5Y4 1/20 0.39
▸ PTPN7 P35236 1/20 0.39

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
SCHEMBL13603876 0.84 ALDH1A1 (0.54) CA1CA2SLC6A2SLC6A3
SCHEMBL13645010 0.83 CA1 (0.55) CA1CA2FNTAFNTB
SCHEMBL13681074 0.83 NR3C1 (0.51) CA1CA2
SCHEMBL13603920 0.80 ALDH1A1 (0.59) CA1CA2SLC6A2SLC6A3
SCHEMBL6910501 0.79 CYP1A2 (0.51) MAOBCYP1A2SLC1A3SLC1A2SLC1A1
SCHEMBL13603903 0.78 POLB (0.49) MAOBCA1CA2
SCHEMBL6910495 0.77 SLC1A3 (0.50) CYP1A2SLC1A3SLC1A2SLC1A1CASP1
SCHEMBL13645009 0.76 KEAP1 (0.50) CA1CA2PPARGKEAP1NFE2L2
SCHEMBL6443298 0.75 SLC1A3 (0.55) MAOBCYP1A2SLC1A3SLC1A2SLC1A1
SCHEMBL8852613 0.75 INSR (0.49) MAOBCYP1A2KEAP1NFE2L2PTPN7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7635181-B2 Ink for ink jet-recording curable through irradiation with a radioactive ray and method for preparing lithographic printing plates using the same FUJIFILM CORPORATION (JP) 2009-12-22 — — US disclosed
US-7635181-B2 Ink for ink jet-recording curable through irradiation with a radioactive ray and method for preparing lithographic printing plates using the same FUJIFILM CORPORATION (JP) 2009-12-22 — — US disclosed
US-7582410-B2 butadiene-styrene copolymer binder and a compound which undergoes decarboxylation due to heat, generates carbon dioxide gas, assists thermal decomposition of the coexisting binder polymer; high engraving sensitivity with low laser energy; forming flexographic printing plate FUJIFILM CORPORATION (JP) 2009-09-01 — — US disclosed
US-7582410-B2 butadiene-styrene copolymer binder and a compound which undergoes decarboxylation due to heat, generates carbon dioxide gas, assists thermal decomposition of the coexisting binder polymer; high engraving sensitivity with low laser energy; forming flexographic printing plate FUJIFILM CORPORATION (JP) 2009-09-01 — — US disclosed
US-7416835-B2 Polymerizable composition FUJIFILM CORPORATION (JP) 2008-08-26 — — US disclosed
US-7416835-B2 Polymerizable composition FUJIFILM CORPORATION (JP) 2008-08-26 — — US disclosed
US-20080038663-A1 butadiene-styrene copolymer binder and a compound which undergoes decarboxylation due to heat, generates carbon dioxide gas, assists thermal decomposition of the coexisting binder polymer; high engraving sensitivity with low laser energy; forming flexographic printing plate FUJIFILM CORPORATION (JP) 2008-02-14 — — US disclosed
US-20080038663-A1 butadiene-styrene copolymer binder and a compound which undergoes decarboxylation due to heat, generates carbon dioxide gas, assists thermal decomposition of the coexisting binder polymer; high engraving sensitivity with low laser energy; forming flexographic printing plate FUJIFILM CORPORATION (JP) 2008-02-14 — — US disclosed
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