SCHEMBL2641082

SCHEMBL2641082

C=C(C)C(=O)OCCOCCOP(=O)(O)O

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.59
TSHR P16473 7/20 0.44
ALDH1A1 P00352 5/20 0.40
LPAR3 Q9UBY5 6/20 0.36
LPAR2 Q9HBW0 4/20 0.36
LPAR1 Q92633 3/20 0.36
BTN3A1 O00481 1/20 0.36
POLB P06746 1/20 0.35
APEX1 P27695 1/20 0.35
HTT P42858 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
TP53 P04637 2/20 0.34
HIF1A Q16665 2/20 0.34
HSD17B10 Q99714 1/20 0.34
CYP3A4 P08684 1/20 0.32

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
SCHEMBL4066760 1.00 THRB (0.59) THRBTSHRALDH1A1LPAR3LPAR2
SCHEMBL5424148 1.00 THRB (0.59) THRBTSHRALDH1A1LPAR3LPAR2
SCHEMBL4066752 1.00 THRB (0.59) THRBTSHRALDH1A1LPAR3LPAR2
SCHEMBL6690732 1.00 THRB (0.59) THRBTSHRALDH1A1LPAR3LPAR2
Ammonia Solution, Strong SCHEMBL18140871 0.98 THRB (0.58) THRBTSHRALDH1A1LPAR3LPAR2
Ammonia Solution, Strong SCHEMBL18140250 0.98 THRB (0.58) THRBTSHRALDH1A1LPAR3LPAR2
SCHEMBL41531 0.94 THRB (0.55) THRBTSHRALDH1A1LPAR3LPAR2
SCHEMBL29614442 0.94 THRB (0.55) THRBTSHRALDH1A1LPAR3LPAR2
Ethylene SCHEMBL42784 0.93 THRB (0.53) THRBTSHRALDH1A1LPAR3LPAR2
Ammonia Solution, Strong SCHEMBL18139579 0.93 THRB (0.53) THRBTSHRALDH1A1LPAR3LPAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110790872-B Viscosity-reducing polycarboxylate superplasticizer with micro-crosslinking structure and preparation method thereof 中建西部建设股份有限公司 2022-08-05 CN claimed
CN-110790872-A Viscosity-reducing polycarboxylate superplasticizer with micro-crosslinking structure and preparation method thereof 中建西部建设股份有限公司 2020-02-14 CN claimed
JP-4746543-B2 2011-08-10 JP claimed
US-7700668-B2 Adhesive composition with decreased polarity upon polymerization 3M ESPE AG (DE) 2010-04-20 US claimed
EP-1639987-B1 Dental adhesive composition 3M ESPE AG (DE) 2009-08-12 EP claimed
US-20060270751-A1 Adhesive composition with decreased polarity upon polymerization 3M DEUTSCHLAND GMBH (DE) 2006-11-30 US claimed
EP-1498098-B1 Adhesive composition with decreased polarity upon polymerization 3M ESPE AG (DE) 2006-05-03 EP claimed
US-20060069181-A1 Dental adhesive composition 3M ESPE AG 2006-03-30 US claimed
EP-1639987-A1 Dental adhesive composition 3M Espe AG (DE) 2006-03-29 EP claimed
WO-2005004819-A1 ADHESIVE COMPOSITION WITH DECREASED POLARITY UPON POLYMERIZATION 3M ESPE AG (DE) 2005-01-20 WO claimed
EP-1498098-A1 Adhesive composition with decreased polarity upon polymerization 3M ESPE AG (DE) 2005-01-19 EP claimed
US-5151479-A A polymerizable phosphate salt, a radical polymerizable unsaturated monomer and an initiator MITSUBISHI RAYON CO., LTD. (JP) 1992-09-29 US claimed
CN-110790872-B Viscosity-reducing polycarboxylate superplasticizer with micro-crosslinking structure and preparation method thereof 中建西部建设股份有限公司 2022-08-05 CN disclosed
US-20200339798-A1 CURABLE COMPOSITIONS BASED ON IMMISCIBLE REACTIVE COMPONENTS AND BLOCK COPOLYMER ARKEMA FRANCE (FR) 2020-10-29 US disclosed
CN-110790872-A Viscosity-reducing polycarboxylate superplasticizer with micro-crosslinking structure and preparation method thereof 中建西部建设股份有限公司 2020-02-14 CN disclosed
US-20180163056-A1 HYDROPHILIC CURABLE COMPOSITIONS MITSUI CHEMICALS, INC. (JP) 2018-06-14 US disclosed
EP-0699961-A1 PHOTOSENSITIVE COMPOSITION, PHOTOSENSITIVE RUBBER PLATE AND PROCESS FOR PRODUCING THE PLATE, AND FLEXOGRAPHIC PLATE AND PROCESS FOR PRODUCING THE PLATE NIPPON ZEON CO., LTD. (JP) 1996-03-06 EP disclosed
US-5151479-A A polymerizable phosphate salt, a radical polymerizable unsaturated monomer and an initiator MITSUBISHI RAYON CO., LTD. (JP) 1992-09-29 US disclosed
US-4576793-A MULTILAYER, POROSITY, SPREADING, UNSATURATED ACID COPOLYMEWR KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1986-03-18 US disclosed
US-4304850-A CONJUGATED DIENE-UNSATURATED ACID INTERPOLYMER LATEX KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1981-12-08 US 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-20060270751-A1 Adhesive composition with decreased polarity upon polymerization PTK2, PHOSPHO1, ITGA1 THRB 3495/4885TSHR 4650/4885ALDH1A1 1541/4885

“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.