SCHEMBL3265039

SCHEMBL3265039

C=C(C)C(=O)OCCOC(=O)C(=O)OCC

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.73
TSHR P16473 5/20 0.59
ALDH1A1 P00352 8/20 0.47
LMNA P02545 1/20 0.44
HSD17B10 Q99714 1/20 0.44
GLO1 Q04760 1/20 0.43
MGAM O43451 1/20 0.42
GAA P10253 1/20 0.42
SI P14410 1/20 0.42
MGAM2 Q2M2H8 1/20 0.42
POLB P06746 1/20 0.40
APEX1 P27695 1/20 0.40
HTT P42858 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MAPT P10636 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
ALOX15 P16050 1/20 0.37
SOAT1 P35610 1/20 0.37

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
SCHEMBL7092835 0.98 THRB (0.76) THRBTSHRALDH1A1LMNAHSD17B10
SCHEMBL10868848 0.93
SCHEMBL17973524 0.91 THRB (0.68) THRBTSHRALDH1A1LMNAHSD17B10
SCHEMBL9161641 0.91 THRB (0.71) THRBTSHRALDH1A1LMNAHSD17B10
SCHEMBL18101452 0.91 THRB (0.71) THRBTSHRALDH1A1LMNAHSD17B10
SCHEMBL19409375 0.91 THRB (0.64) THRBTSHRALDH1A1LMNAHSD17B10
SCHEMBL15030 0.91
Ethyl Acetate SCHEMBL28232168 0.89 THRB (0.70) THRBTSHRALDH1A1LMNAHSD17B10
SCHEMBL1001162 0.89 THRB (0.64) THRBTSHRALDH1A1LMNAHSD17B10
Ammonia Solution, Strong SCHEMBL2598325 0.88

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9988558-B2 Repulpable adhesives TESA SE (DE) 2018-06-05 US claimed
US-9988558-B2 Repulpable adhesives TESA SE (DE) 2018-06-05 US disclosed
EP-2883699-B1 A lithographic printing plate precursor and monomer AGFA GRAPHICS NV (BE) 2017-05-03 EP disclosed
US-20160282718-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR AGFA OFFSET BV (BE) 2016-09-29 US disclosed
US-20160282718-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR AGFA OFFSET BV (BE) 2016-09-29 US disclosed
WO-2015086659-A1 A LITHOGRAPHIC PRINTING PLATE PRECURSOR AND MONOMER AGFA GRAPHICS NV (BE) 2015-06-18 WO disclosed
EP-2883699-A1 A lithographic printing plate precursor and monomer AGFA GRAPHICS NV (BE) 2015-06-17 EP disclosed
CN-101676344-B Repulpable adhesive TESA SE 2014-08-13 CN disclosed
CN-101676344-A Repulpable adhesive TESA SE 2010-03-24 CN disclosed
US-20100065207-A1 REPULPABLE ADHESIVES TESA SE (DE) 2010-03-18 US disclosed
US-5442096-A Compound contains a alpha-ketoester and a polymerizable double bond NIPPON PAINT CO., LTD. (JP) 1995-08-15 US disclosed
EP-0378429-B1 Polymerisable compound and polymer therefrom NIPPON PAINT CO LTD (JP) 1994-12-14 EP disclosed
EP-0621258-A1 Polymerisable compound and polymer therefrom Nippon Paint Co., Ltd. (JP) 1994-10-26 EP disclosed
US-5356979-A Addition polymers for underwater structures HITACHI CHEMICAL COMPANY, LTD. (JP) 1994-10-18 US disclosed
US-5248749-A Adhesives and coatings NIPPON PAINT CO., LTD. (JP) 1993-09-28 US disclosed
EP-0550998-A1 Coating resin and antifouling coating composition HITACHI CHEMICAL COMPANY, LTD. (JP) 1993-07-14 EP disclosed
US-5169896-A Curable mixture of compound having at least two hydroxyl group and homo- or copolymer with alpha-ketoester group and double bond; esterification; coatings, adhesives, plastics NIPPON PAINT CO., LTD. (JP) 1992-12-08 US disclosed
US-5117044-A Unsaturated ester NIPPON PAINT CO., LTD. (JP) 1992-05-26 US disclosed
EP-0387831-A2 Resin composition curable at low temperature NIPPON PAINT CO., LTD. (JP) 1990-09-19 EP disclosed
EP-0378429-A2 Polymerisable compound and polymer therefrom NIPPON PAINT CO., LTD. (JP) 1990-07-18 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160282718-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR LOXL1, LOXL2, LOXL3 THRB 2550/4885TSHR 4209/4885ALDH1A1 1892/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.