SCHEMBL6914907

SCHEMBL6914907

C=C(C)C(=O)OCC(COC(=O)C(=C)C)OC(C)=O

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.61
THRB P10828 1/20 0.42
PRKCA P17252 2/20 0.40
ALDH1A1 P00352 2/20 0.40
TDP1 Q9NUW8 1/20 0.38
AR P10275 1/20 0.36
MEN1 O00255 1/20 0.35
CYP1A2 P05177 1/20 0.35
HRH1 P35367 1/20 0.35
KMT2A Q03164 1/20 0.35
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL8682586 0.96 TSHR (0.57) TSHRTHRBPRKCAALDH1A1TDP1
SCHEMBL8989287 0.90 TSHR (0.55) TSHRTHRBPRKCA
SCHEMBL16803284 0.89 TSHR (0.63) TSHRTHRBPRKCAALDH1A1TDP1
SCHEMBL35507 0.89 TSHR (0.63) TSHRTHRBPRKCAALDH1A1TDP1
SCHEMBL9818660 0.89 TSHR (0.53) TSHRTHRBPRKCAALDH1A1TDP1
SCHEMBL6914911 0.88 TSHR (0.57) TSHRTHRBPRKCAALDH1A1TDP1
SCHEMBL18567468 0.88 TSHR (0.49) TSHRTHRBPRKCAALDH1A1
SCHEMBL19197757 0.86 TSHR (0.59) TSHRTHRBPRKCAALDH1A1LMNA
SCHEMBL22188617 0.86 SMN1; SMN2 (0.51) TSHRTHRBPRKCAALDH1A1MEN1
SCHEMBL20680945 0.86 SMN1; SMN2 (0.51) TSHRTHRBPRKCAALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210155814-A1 ACTIVE-ENERGY-RAY-CURABLE AQUEOUS COMPOSITION, ACTIVE-ENERGY-RAY-CURABLE AQUEOUS INK, STORED CONTAINER, IMAGE FORMING APPARATUS, IMAGE FORMING METHOD, CURED PRODUCT, AND DECORATED PRODUCT RICOH COMPANY, LTD. (JP) 2021-05-27 US disclosed
US-20210061929-A1 ACTIVE-ENERGY-RAY-CURABLE COMPOSITION, ACTIVE-ENERGY-RAY-CURABLE INK, COMPOSITION STORED CONTAINER, TWO-DIMENSIONAL OR THREE-DIMENSIONAL IMAGE FORMING METHOD AND APPARATUS, CURED PRODUCT, AND DECORATED PRODUCT RICOH COMPANY, LTD. (JP) 2021-03-04 US disclosed
US-10829631-B2 Composition, accommodating unit, image forming device, and image forming method RICOH COMPANY, LTD. (JP) 2020-11-10 US disclosed
US-20200299425-A1 ACTIVE ENERGY RAY CURABLE COMPOSITION, ACTIVE ENERGY RAY CURABLE INK, COMPOSITION ACCOMMODATING CONTAINER, TWO OR THREE DIMENSIONAL IMAGE FORMING APPARATUS, TWO OR THREE DIMENSIONAL IMAGE FORMING METHOD, CURED MATTER, DECORATIVE MATTER, ARTIFICIAL NAIL COMPOSITION, NAIL DECORATIVE MATERIAL, AND ARTIFICIAL NAIL RICOH COMPANY, LTD. (JP) 2020-09-24 US disclosed
US-20200038309-A1 COMPOSITION, ARTIFICIAL NAIL COMPOSITION, NAIL DECORATION MATERIAL, ARTIFICIAL NAIL, STORED CONTAINER, IMAGE FORMING APPARATUS, AND IMAGE FORMING METHOD RICOH COMPANY, LTD. (JP) 2020-02-06 US disclosed
US-10392394-B2 Antimicrobial compounds and methods BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 2019-08-27 US disclosed
US-10174215-B2 Ink, ink cartridge, inkjet recording apparatus, printed matter, photopolymerizable compound, photocurable composition, three-dimensional object formation material, and three-dimensional object RICOH COMPANY, LTD. (JP) 2019-01-08 US disclosed
US-20180155353-A1 Antimicrobial Compounds and Methods BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 2018-06-07 US disclosed
US-9920062-B2 Antimicrobial monomers and polymers, and their use in dental devices BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 2018-03-20 US disclosed
US-20170183519-A1 INK, INK CARTRIDGE, INKJET RECORDING APPARATUS, PRINTED MATTER, PHOTOPOLYMERIZABLE COMPOUND, PHOTOCURABLE COMPOSITION, THREE-DIMENSIONAL OBJECT FORMATION MATERIAL, AND THREE-DIMENSIONAL OBJECT RICOH COMPANY, LTD. (JP) 2017-06-29 US disclosed
US-20170183519-A1 INK, INK CARTRIDGE, INKJET RECORDING APPARATUS, PRINTED MATTER, PHOTOPOLYMERIZABLE COMPOUND, PHOTOCURABLE COMPOSITION, THREE-DIMENSIONAL OBJECT FORMATION MATERIAL, AND THREE-DIMENSIONAL OBJECT RICOH COMPANY, LTD. (JP) 2017-06-29 US disclosed
US-20110082250-A1 Silane and Silicic Acid Polycondensates with Radicals Containing Branched-Chain Urethane, Acid Amide and/or Carboxylic Acid Ester Groups FRAUNHOFER-GESELLSCHAFT ZUR FOERDERUNG DER ANGEWANDTEN FORSCHUNG E. V. (DE) 2011-04-07 US disclosed
EP-1173404-B1 ACRYLATE MONOMER PREPARATION USING ALKALI METAL ALKOXIDES AS ESTER INTERCHANGE CATALYSTS AND BROMIDE SALT POLYMERIZATION INHIBITORS CIBA SC HOLDING AG (CH) 2004-02-04 EP disclosed
EP-1327622-A1 Acrylate monomer preparation using alkali metal alkoxides as ester interchange catalysts Ciba Specialty Chemicals Holding Inc. (CH) 2003-07-16 EP disclosed
EP-1173404-A1 ACRYLATE MONOMER PREPARATION USING ALKALI METAL ALKOXIDES AS ESTER INTERCHANGE CATALYSTS AND BROMIDE SALT POLYMERIZATION INHIBITORS Ciba SC Holding AG (CH) 2002-01-23 EP disclosed
US-6215018-B1 Acrylate monomer preparation using alkali metal alkoxides as ester interchange catalysts and bromide salt polymerization inhibitors CIBA SPECIALTY CHEMICALS CORPORATION 2001-04-10 US disclosed
WO-2000064851-A1 ACRYLATE MONOMER PREPARATION USING ALKALI METAL ALKOXIDES AS ESTER INTERCHANGE CATALYSTS AND BROMIDE SALT POLYMERIZATION INHIBITORS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2000-11-02 WO disclosed
US-6008404-A REACTING AN ALCOHOL OR POLYOL WITH AN ESTER OF A METHACRYLATE OR ACRYLATE IN PRESENCE OF TRANSESTERIFICATION CATALYST AND AN ALKALI METAL BROMIDE SALT TO PRODUCE ALCOHOL OR POLYOL ESTER OF ACRYLATE/METHACRYLATE FREE OF POLYMERIC DERIVATIVE CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-12-28 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 (6 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-20170183519-A1 INK, INK CARTRIDGE, INKJET RECORDING APPARATUS, PRINTED MATTER, PHOTOPOLYMERIZABLE COMPOUND, PHOTOCURABLE COMPOSITION, THREE-DIMENSIONAL OBJECT FORMATION MATERIAL, AND THREE-DIMENSIONAL OBJECT DOT1L, RB1, DNMT3A TSHR 4440/4885THRB 4284/4885PRKCA 1453/4885
US-20110082250-A1 Silane and Silicic Acid Polycondensates with Radicals Containing Branched-Chain Urethane, Acid Amide and/or Carboxylic Acid Ester Groups ORC3, BCAT1, MSR1 TSHR 4007/4885THRB 3405/4885PRKCA 4252/4885
US-10392394-B2 Antimicrobial compounds and methods GSDMD, AAAS, ACMSD TSHR 4859/4885THRB 4813/4885PRKCA 4251/4885
US-20200038309-A1 COMPOSITION, ARTIFICIAL NAIL COMPOSITION, NAIL DECORATION MATERIAL, ARTIFICIAL NAIL, STORED CONTAINER, IMAGE FORMING APPARATUS, AND IMAGE FORMING METHOD NACA, PIK3C3, DPM1 TSHR 1601/4885THRB 2633/4885PRKCA 4810/4885
US-20180155353-A1 Antimicrobial Compounds and Methods GSDMD, AAAS, ACMSD TSHR 4859/4885THRB 4813/4885PRKCA 4251/4885
US-10174215-B2 Ink, ink cartridge, inkjet recording apparatus, printed matter, photopolymerizable compound, photocurable composition, three-dimensional object formation material, and three-dimensional object DOT1L, RB1, DNMT3A TSHR 4440/4885THRB 4284/4885PRKCA 1453/4885

“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.