SCHEMBL932598

SCHEMBL932598

C=C(C)C(=O)OCCO.C=CC(=O)OCCO

nearest known ligand 0.70

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 10/20 0.70
HPGD P15428 1/20 0.48
ALDH1A1 P00352 7/20 0.48
TP53 P04637 3/20 0.48
HIF1A Q16665 3/20 0.48
CYP3A4 P08684 2/20 0.48
HSD17B10 Q99714 1/20 0.48
THRB P10828 3/20 0.47
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
POLB P06746 1/20 0.36
APEX1 P27695 1/20 0.36
HTT P42858 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
ATM Q13315 1/20 0.31

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
SCHEMBL21313305 0.93 TSHR (0.61) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL1548515 0.93 TSHR (0.61) TSHRHPGDALDH1A1TP53HIF1A
Phosphoric Acid SCHEMBL27691597 0.93 TSHR (0.61) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL9853352 0.93 TSHR (0.61) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL28033748 0.92 TSHR (0.59) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL9421551 0.92 TSHR (0.59) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL21084614 0.92 TSHR (0.59) TSHRHPGDALDH1A1TP53HIF1A
Acrylic Acid Ethyl Ester SCHEMBL5072675 0.91 TSHR (0.58) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL5437346 0.91 TSHR (0.67) TSHRHPGDALDH1A1TP53HIF1A
Hydrochloric Acid SCHEMBL9751736 0.91 TSHR (0.58) TSHRHPGDALDH1A1TP53HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117188191-A Non-close-packed photonic crystal structure chromogenic fabric and preparation method thereof 浙江理工大学 2023-12-08 CN claimed
US-10364365-B2 Curable colored inks for making colored silicone hydrogel lenses NOVARTIS AG (CH) 2019-07-30 US claimed
CN-101870649-A Method for preparing adamantyl unsaturated ester UNIV BEIJING CHEMICAL 2010-10-27 CN claimed
US-6696535-B2 SOLUTION ADDITION COPOLYMERIZATION INCLUDING REACTABLE MONOMERS; CARBAMYLATION BASF CORPORATION 2004-02-24 US claimed
US-6514734-B1 Pendent bioactive groups function by promoting attachment of specific molecules or cells to the bulk material or coated surface; bioactive groups can include proteins, peptides, carbohydrates, and nucleic acids; e.g. neurons to electrodes SURMODICS, INC. 2003-02-04 US claimed
US-5306762-A Aqueous acrylic laminating inks with improved peel strength WESTVACO CORPORATION (US) 1994-04-26 US claimed
EP-0561078-A2 Process for control of molecular weight distribution in polymers ROHM AND HAAS COMPANY (US) 1993-09-22 EP claimed
JP-57129413-A None JP disclosed
CN-114729090-B Two-component (2K) curable compositions 汉高股份有限及两合公司 2025-01-28 CN disclosed
CN-117188191-A Non-close-packed photonic crystal structure chromogenic fabric and preparation method thereof 浙江理工大学 2023-12-08 CN disclosed
CN-117042728-A Implant 斯卡勒植入物公司 2023-11-10 CN disclosed
WO-2022049712-A1 LEAD WIRE FOR NONAQUEOUS ELECTROLYTE BATTERIES, NONAQUEOUS ELECTROLYTE BATTERY, AND METHOD FOR PRODUCING LEAD WIRE FOR NONAQUEOUS ELECTROLYTE BATTERIES 住友電気工業株式会社 2022-03-10 WO disclosed
CN-106009957-A ACRYLIC POLYMERS, 1K COATING COMPOSITIONS INCLUDING THE SAME, AND MULTILAYER COATING SYSTEMS INCLUDING A TOPCOAT LAYER FORMED FROM THE 1K COATING COMPOSITIONS 涂层国外知识产权有限公司 2016-10-12 CN disclosed
WO-1997049686-A1 NOVEL POLYMERIZABLE ACYL IMIDAZOLIDINONE MONOMERS CYTEC TECHNOLOGY CORP. (US) 1997-12-31 WO disclosed
US-4517350-A REACTION OF ACRYLIC ACID AND AMINE TOKUYAMA SEKISUI KOGYO KABUSHIKI KAISHA (JP) 1985-05-14 US disclosed
JP-S57129413-A LIQUID CRYSTAL DISPLAY DEVICE HITACHI LTD 1982-08-11 JP disclosed
EP-0022336-A1 Premix compositions for use in the production of flame retardant polyurethane foams AIR PRODUCTS AND CHEMICALS, INC. (US) 1981-01-14 EP disclosed
US-4164423-A CARBON BLACK, PHYSICAL PROPERTIES DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DE) 1979-08-14 US disclosed
US-4137389-A Low-molecular weight acrylate resins and a process for their production BAYER AKTIENGESELLSCHAFT (DE) 1979-01-30 US disclosed
US-4107114-A MIXTURE OF MONOETHYLENICALLY AND POLYETHYLENICALLY UNSATURATED MONOMERS AND EMULSIFIER KANSAI PAINT COMPANY, LIMITED (JP) 1978-08-15 US disclosed