SCHEMBL3899274

SCHEMBL3899274

C=C(C)C(=O)OCCCOCC(O)CO

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.49
USP2 O75604 2/20 0.49
THRB P10828 1/20 0.46
PLA2G2C Q5R387 1/20 0.39
HTT P42858 2/20 0.38
POLB P06746 1/20 0.38
APEX1 P27695 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
KDM4E B2RXH2 2/20 0.37
DUSP3 P51452 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
LMNA P02545 1/20 0.37
ALDH1A1 P00352 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C19 P33261 1/20 0.33
ALOX15 P16050 1/20 0.33
DGKA P23743 1/20 0.33
LPAR5 Q9H1C0 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
SCHEMBL25543184 0.97 TSHR (0.53) TSHRUSP2THRBPLA2G2CHTT
SCHEMBL5907719 0.90 THRB (0.58) TSHRUSP2THRBPLA2G2CHTT
SCHEMBL19698628 0.87 TSHR (0.49) TSHRUSP2THRBPLA2G2CHTT
SCHEMBL12624218 0.85 TSHR (0.50) TSHRUSP2THRBPLA2G2CHTT
SCHEMBL996289 0.85 TSHR (0.53) TSHRUSP2THRBPLA2G2CHTT
SCHEMBL633281 0.84 USP2 (0.49) TSHRUSP2PLA2G2CHTTKDM4E
SCHEMBL29261094 0.83 TSHR (0.55) TSHRUSP2THRBHTTPOLB
Glycerin SCHEMBL1930797 0.83 TSHR (0.65) TSHRUSP2THRBPLA2G2CHTT
SCHEMBL7796484 0.82 TSHR (0.50) TSHRTHRBPLA2G2CHTTPOLB
SCHEMBL1834629 0.82 THRB (0.56) TSHRUSP2THRBHTTPOLB

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
US-20190345353-A1 SINGLE PHASE WATER BASED ENERGY CURABLE COMPOSITIONS AND METHOD OF PREPARING COATINGS AND PRINTING INKS SUN CHEMICAL CORPORATION (US) 2019-11-14 US claimed
US-20160362568-A1 SINGLE PHASE WATER BASED ENERGY CURABLE COMPOSITIONS AND METHOD OF PREPARING COATINGS AND PRINTING INKS SUN CHEMICAL CORPORATION (US) 2016-12-15 US claimed
EP-1869097-B1 WATER BASED ENERGY CURABLE HYBRID SYSTEMS WITH IMPROVED PROPERTIES SUN CHEMICAL CORP (US) 2014-06-11 EP claimed
US-7479511-B2 Water based energy curable hybrid systems with improved properties SUN CHEMICAL CORPORATION (US) 2009-01-20 US claimed
JP-2008536004-A 2008-09-04 JP claimed
EP-1792956-B1 Single phase aqueous energy curable compositions SUN CHEMICAL CORP (US) 2008-07-16 EP claimed
EP-1869097-A2 WATER BASED ENERGY CURABLE HYBRID SYSTEMS WITH IMPROVED PROPERTIES Sun Chemical Corporation (US) 2007-12-26 EP claimed
EP-1504067-B1 SINGLE PHASE WATER BASED ENERGY CURABLE COMPOSITIONS AND A METHOD OF PREPARING COATINGS AND PRINTING INKS SUN CHEMICAL CORP (US) 2007-10-17 EP claimed
EP-1792956-A1 Single phase aqueous energy curable compositions Sun Chemical Corporation (US) 2007-06-06 EP claimed
WO-2006110784-A2 WATER BASED ENERGY CURABLE HYBRID SYSTEMS WITH IMPROVED PROPERTIES SUN CHEMICAL CORPORATION (US) 2006-10-19 WO claimed
US-20060229412-A1 Water based energy curable hybrid systems with improved properties SUN CHEMICAL CORPORATION 2006-10-12 US claimed
EP-1504067-A1 SINGLE PHASE WATER BASED ENERGY CURABLE COMPOSITIONS AND A METHOD OF PREPARING COATINGS AND PRINTING INKS SUN CHEMICAL CORPORATION (US) 2005-02-09 EP claimed
WO-2003093378-A1 SINGLE PHASE AQUEOUS ENERGY CURABLE COMPOSITIONS SUN CHEMICAL CORPORATION (US) 2003-11-13 WO claimed