SCHEMBL2555045

SCHEMBL2555045

NOC(=O)C(=O)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 9/20 0.59
CES1 P23141 8/20 0.59
TSHR P16473 3/20 0.48
MAPT P10636 3/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
POLB P06746 2/20 0.48
CYP3A4 P08684 1/20 0.48
PARP1 P09874 1/20 0.48
CYP2C19 P33261 1/20 0.48
RECQL P46063 1/20 0.48
BLM P54132 1/20 0.48
PMP22 Q01453 1/20 0.48
HSD17B10 Q99714 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
F2 P00734 1/20 0.46
LMNA P02545 1/20 0.46
ALDH1A1 P00352 4/20 0.46
DAO P14920 1/20 0.46
NAPRT Q6XQN6 1/20 0.46
KDM4E B2RXH2 1/20 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
SCHEMBL8789333 0.81 MAPT (0.48) CES2CES1TSHRMAPTL3MBTL1
SCHEMBL9750434 0.80 CES2 (0.65) CES2CES1TSHRMAPTL3MBTL1
SCHEMBL5041038 0.80 CES2 (0.46) CES2CES1TSHRMAPTL3MBTL1
SCHEMBL4094781 0.78 CES2 (0.62) CES2CES1TSHRMAPTL3MBTL1
SCHEMBL27327074 0.77 CES2 (0.54) CES2CES1TSHRMAPTL3MBTL1
SCHEMBL4089336 0.77 TDP1 (0.50) CES2CES1TSHRMAPTL3MBTL1
Benzil SCHEMBL2234045 0.76 CES2 (0.88) CES2CES1TSHRMAPTL3MBTL1
SCHEMBL20040504 0.76 CES2 (0.59) CES2CES1TSHRMAPTL3MBTL1
SCHEMBL11648519 0.76 CES2 (0.59) CES2CES1TSHRMAPTL3MBTL1
SCHEMBL27957931 0.76 CES2 (0.59) CES2CES1TSHRMAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103119208-A A biocidal polyolefin yarn with 3-12 filaments VESTERGAARD FRANDSEN SA 2013-05-22 CN claimed
WO-2011124228-A1 A BIOCIDAL POLYOLEFIN YARN WITH 3-12 FILAMENTS VESTERGAARD FRANDSEN SA (CH) 2011-10-13 WO claimed
WO-2011124227-A1 BIOCIDAL ACID-ADJUSTED POLYMER WITH POLYPROPYLENE VESTERGAARD FRANDSEN SA (CH) 2011-10-13 WO claimed
EP-3284599-B1 LITHOGRAPHIC PRINTING PLATE PRECURSOR AND LITHOGRAPHIC PRINTING METHOD USING THE SAME FUJIFILM CORP (JP) 2019-07-03 EP disclosed
EP-3284599-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR AND LITHOGRAPHIC PRINTING METHOD USING THE SAME Fujifilm Corporation (JP) 2018-02-21 EP disclosed
CN-103119208-A A biocidal polyolefin yarn with 3-12 filaments VESTERGAARD FRANDSEN SA 2013-05-22 CN disclosed
WO-2011124227-A1 BIOCIDAL ACID-ADJUSTED POLYMER WITH POLYPROPYLENE VESTERGAARD FRANDSEN SA (CH) 2011-10-13 WO disclosed
WO-2011124228-A1 A BIOCIDAL POLYOLEFIN YARN WITH 3-12 FILAMENTS VESTERGAARD FRANDSEN SA (CH) 2011-10-13 WO disclosed
CN-101684206-A Environment-friendly direct dye GUIYANG SUN 2010-03-31 CN disclosed
EP-1975706-A2 Lithographic printing plate precursor FUJIFILM Corporation (JP) 2008-10-01 EP disclosed
EP-1534685-A1 1H-INDAZOLE-3-CARBOXAMIDE COMPOUNDS AS CYCLIN DEPENDENT KINASES (CDK) INHIBITORS Astex Technology Limited (GB) 2005-06-01 EP disclosed
WO-2005014554-A1 1H-INDAZOLE-3-CARBOXAMIDE COMPOUNDS AS MAPKAP KINASE MODULATORS ASTEX THERAPEUTICS LIMITED (GB) 2005-02-17 WO disclosed
WO-2004014864-A1 1H-INDAZOLE-3-CARBOXAMIDE COMPOUNDS AS CYCLIN DEPENDENT KINASES (CDK) INHIBITORS ASTEX TECHNOLOGY LIMITED (GB) 2004-02-19 WO disclosed