SCHEMBL753789

SCHEMBL753789

c1ccc2c(C(OCC3CO3)C3CO3)cccc2c1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.38
ALDH1A1 P00352 3/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
TP53 P04637 1/20 0.37
CYP3A4 P08684 1/20 0.37
TSHR P16473 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HIF1A Q16665 1/20 0.37
AOC3 Q16853 1/20 0.37
ACP3 P15309 2/20 0.36
GLA P06280 1/20 0.36
KDM4E B2RXH2 1/20 0.35
CASR P41180 3/20 0.34
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33

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
SCHEMBL1893357 0.82 ALDH1A1 (0.44) ALDH1A1CYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL28415101 0.81 ACP3 (0.39) TDP1ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL29267774 0.81 ALDH1A1 (0.49) TDP1ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL1700175 0.79 ADRA2A (0.43) ALDH1A1CYP1A2CYP2C9CYP2C19TSHR
SCHEMBL27695206 0.79 AOC3 (0.45) TDP1ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL12781446 0.79 TDP1 (0.41) TDP1ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL1170735 0.75 TDP1 (0.49) TDP1ALDH1A1TP53CYP3A4TSHR
SCHEMBL9304523 0.74 TDP1 (0.38) TDP1ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL8522781 0.72 CYP2C9 (0.44) TDP1ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL7299447 0.70 ALDH1A1 (0.46) ALDH1A1CYP1A2CYP2C9CYP2C19TSHR

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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2292430-B1 INKJET RECORDING DEVICE AND INKJET RECORDING METHOD KONICA MINOLTA HOLDINGS INC (JP) 2015-01-07 EP disclosed
US-8454152-B2 Ink jet recording device and ink jet recording method KONICA MINOLTA HOLDINGS, INC. (JP) 2013-06-04 US disclosed
US-8349916-B2 Actinic energy radiation curable ink-jet ink, ink-jet recording method, and printed matter KONICA MINOLTA IJ TECHNOLOGIES, INC. (JP) 2013-01-08 US disclosed
EP-2228415-B1 Actinic energy radiation curable ink-jet ink, ink-jet recoring method, and printed matter KONICA MINOLTA IJ TECHNOLOGIES (JP) 2012-03-21 EP disclosed
US-20110165387-A1 ACTINIC ENERGY RADIATION CURABLE INK-JET INK, IMAGE FORMING METHOD USING THE SAME, AND PRINTED MATTER OBTAINED THEREBY KONICA MINOLTA IJ TECHNOLOGIES, INC. (JP) 2011-07-07 US disclosed
US-20110096132-A1 INK JET RECORDING DEVICE AND INK JET RECORDING METHOD KONICA MINOLTA HOLDINGS, INC. (JP) 2011-04-28 US disclosed
EP-2292430-A1 INKJET RECORDING DEVICE AND INKJET RECORDING METHOD Konica Minolta Holdings, Inc. (JP) 2011-03-09 EP disclosed
US-20100255211-A1 ACTINIC ENERGY RADIATION CURABLE INK-JET INK AND INK-JET IMAGE FORMING METHOD KONICA MINOLTA IJ TECHNOLOGIES, INC. (JP) 2010-10-07 US disclosed
US-20100233446-A1 ACTINIC ENERGY RADIATION CURABLE INK-JET INK, INK-JET RECORDING METHOD, AND PRINTED MATTER KONICA MINOLTA IJ TECHNOLOGIES, INC. (JP) 2010-09-16 US disclosed
EP-2228415-A1 Acting energy radiation curable ink-jet ink, ink-jet recoring method, and printed matter Konica Minolta IJ Technologies, Inc. (JP) 2010-09-15 EP disclosed
EP-1201638-B1 PHOTOCURABLE COMPOSITION CONTAINING IODONIUM SALT COMPOUND NIPPON SODA CO (JP) 2004-06-23 EP disclosed
US-6677390-B1 CURABLE MIXTURES COMPRISING SENSITIZERS AND HALOGEN COMPOUNDS SUCH AS 4-CARBOXYMETHOXYPHENYL-2',4',6'-TRIMETHYLPHENYL-IODONIUM HEXAFLUOROPHOSPHATE, USED AS NONTOXIC ACID GENERATORS OR CATALYSTS; QUICK SETTING NIPPON SODA CO., LTD. (JP) 2004-01-13 US disclosed
EP-0846681-B1 NOVEL SULFONIUM SALT COMPOUNDS, POLYMERIZATION INITIATOR, CURABLE COMPOSITION, AND CURING METHOD NIPPON SODA CO (JP) 2003-12-03 EP disclosed
US-6558871-B1 Photopolymerization initiator comprising at least one of diaryliodonium salt NIPPON SODA CO. LTD. (JP) 2003-05-06 US disclosed
EP-1201638-A1 PHOTOCURABLE COMPOSITION CONTAINING IODONIUM SALT COMPOUND NIPPON SODA CO., LTD. (JP) 2002-05-02 EP disclosed
US-6313188-B1 USED AS CATALYSTS FOR CATIONIC PHOTOPOLYMERIZATION NIPPON SODA CO., LTD. (JP) 2001-11-06 US disclosed
EP-1106639-A1 PHOTOCURABLE COMPOSITION CONTAINING IODONIUM SALT COMPOUND NIPPON SODA CO., LTD. (JP) 2001-06-13 EP disclosed
US-6093753-A CURABLE COMPOSITION COMPRISING A CATIONIC POLYMERIZABLE COMPOUND WHICH IS AN ALICYCLIC EPOXY COMPOUND OR A VINYL ETHER COMPOUND AND A CATIONIC POLYMERIZATION INITIATOR; PAINTS, ADHESIVES, INKS, PHOTORESISTS NIPPON SODA CO., LTD. (JP) 2000-07-25 US disclosed
EP-0927726-A1 PHOTOCATALYTIC COMPOSITION NIPPON SODA CO., LTD. (JP) 1999-07-07 EP disclosed
EP-0846681-A1 NOVEL SULFONIUM SALT COMPOUNDS, POLYMERIZATION INITIATOR, CURABLE COMPOSITION, AND CURING METHOD NIPPON SODA CO., LTD. (JP) 1998-06-10 EP disclosed