SCHEMBL13611311

SCHEMBL13611311

COC(=O)CN(CC(=O)O)c1cc(CO)c(CO)c(CO)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 1/20 0.40
BLM P54132 1/20 0.40
RAB9A P51151 1/20 0.32
PDE5A O76074 1/20 0.31
PDE4A P27815 1/20 0.31
PDE1A P54750 1/20 0.31
PDE1B Q01064 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 1/20 0.31
PDE3B Q13370 1/20 0.31
PDE1C Q14123 1/20 0.31
PDE3A Q14432 1/20 0.31
PTPN1 P18031 1/20 0.30
PTPN6 P29350 1/20 0.30
PTPN11 Q06124 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPK1 P28482 1/20 0.30
POLB P06746 1/20 0.30
MLYCD O95822 1/20 0.30

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
SCHEMBL13603838 0.77 PLA2G2A (0.42) PLA2G2ABLMRAB9AALDH1A1MAPK1
SCHEMBL13611307 0.76 CYP4F2 (0.39) PLA2G2ABLMRAB9APTPN1PTPN6
SCHEMBL9949346 0.75 MEN1 (0.43) PLA2G2ABLMALDH1A1MAPK1POLB
SCHEMBL3841166 0.74 TDP1 (0.44) PLA2G2ABLMRAB9APTPN1PTPN6
SCHEMBL9949291 0.72 MAPT (0.47) RAB9AALDH1A1MAPK1TSHR
SCHEMBL13680117 0.72 KEAP1 (0.46) RAB9APTPN1ALDH1A1MAPK1POLB
SCHEMBL13603850 0.72 ALDH1A1 (0.40) PLA2G2ABLMRAB9AALDH1A1POLB
SCHEMBL13603843 0.71 ALDH1A1 (0.42) RAB9AALDH1A1POLB
SCHEMBL13603867 0.71 BCHE (0.39) PLA2G2ABLMALDH1A1POLBTSHR
SCHEMBL13645020 0.71 ALDH1A1 (0.43) PLA2G2ABLMRAB9APTPN1PTPN6

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 4 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-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-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