SCHEMBL809780

SCHEMBL809780

C=CC(=O)OCC(C)C#N

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 9/20 0.62
HPGD P15428 1/20 0.41
ALDH1A1 P00352 4/20 0.41
TP53 P04637 3/20 0.41
HIF1A Q16665 3/20 0.41
CYP3A4 P08684 2/20 0.41
HSD17B10 Q99714 1/20 0.41
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
THRB P10828 2/20 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
Acrylic Acid Methyl Ester SCHEMBL28010317 0.93 TSHR (0.55) TSHRHPGDALDH1A1TP53HIF1A
Methacrylic Acid SCHEMBL28025540 0.90 TSHR (0.51) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL28040005 0.82 TSHR (0.84) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL21331667 0.81 TSHR (0.52) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL27578293 0.81 TSHR (0.58) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL3453557 0.81 TSHR (0.61) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL28903788 0.80 TSHR (0.55) TSHRHPGDALDH1A1TP53HIF1A
Water SCHEMBL7201172 0.79 TSHR (0.72) TSHRHPGDALDH1A1TP53HIF1A
Acrylonitrile SCHEMBL11816648 0.79 TSHR (0.78) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL1170959 0.78 TSHR (0.53) 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 124 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119430121-A Repairing method of waste lithium iron phosphate and application thereof 中国科学院深圳先进技术研究院 2025-02-14 CN claimed
EP-3375799-B1 METHOD FOR PRODUCING SEMI-IPN COMPOSITE AND METHOD FOR PRODUCING MOISTURE-PERMEABLE FILM DAINIPPON INK & CHEMICALS (JP) 2025-09-03 EP disclosed
CN-115362215-B Aqueous resin composition and coating agent DIC株式会社 2024-10-18 CN disclosed
CN-115362215-A Aqueous resin composition and coating agent DIC株式会社 2022-11-18 CN disclosed
EP-3375794-B1 METHOD FOR PRODUCING SEMI-IPN COMPOSITE AND METHOD FOR PRODUCING SYNTHETIC LEATHER DAINIPPON INK & CHEMICALS (JP) 2022-10-26 EP disclosed
CN-109790372-B Aqueous resin composition, coating agent, and article DIC株式会社 2022-03-11 CN disclosed
CN-109790371-B Method for producing semi-IPN type complex DIC株式会社 2021-07-20 CN disclosed
EP-3521371-B1 METHOD FOR PRODUCING SEMI-IPN COMPOSITE DAINIPPON INK & CHEMICALS (JP) 2021-06-16 EP disclosed
CN-108350132-B Method for producing semi-IPN type composite and method for producing moisture permeable film DIC株式会社 2021-05-28 CN disclosed
CN-108350104-B Method for producing semi-IPN type composite and method for producing synthetic leather DIC株式会社 2021-03-23 CN disclosed
US-5541258-A CROSSLINKED ACRYLATE COPOLYMER RUBBERS WITH CARBOXY GROUPS AND EPOXY GROUPS NIPPON ZEON CO., LTD. (JP) 1996-07-30 US disclosed
EP-0594854-B1 THERMOPLASTIC ELASTOMER COMPOSITION NIPPON ZEON CO (JP) 1996-05-29 EP disclosed
EP-0594854-A1 THERMOPLASTIC ELASTOMER COMPOSITION NIPPON ZEON CO., LTD. (JP) 1994-05-04 EP disclosed
EP-0593769-A1 THERMOPLASTIC ELASTOMER COMPOSITION NIPPON ZEON CO., LTD. (JP) 1994-04-27 EP disclosed
US-4988751-A Organotin stabilizer, molybdenum smoke retardant for halogenated vinyl polymer WITCO CORPORATION (US) 1991-01-29 US disclosed
EP-0396345-A1 Halogenated vinyl polymer composition and method for stabilizing halogenated vinyl polymer composition containing smoke retardants WITCO CORPORATION (US) 1990-11-07 EP disclosed
US-4942906-A FOR FUEL TRANSPORTATION TOKAI RUBBER INDUSTRIES, LTD. (JP) 1990-07-24 US disclosed
US-4028431-A ETHYLENE-HEXAFLUOROPROPYLENE POLYMER, SILICONE RUBBERS, AND VINYLIDENE FLUORIDE COPOLYMER DAIKIN KOGYO CO., LTD. (JA) 1977-06-07 US disclosed
US-3976627-A Vulcanizable compositions of carboxyl-containing polymers THE B.F. GOODRICH COMPANY (US) 1976-08-24 US disclosed
US-3968065-A Vulcanizable polymer blends of a halogen-containing polymer and a carboxyl-containing polymer THE B. F. GOODRICH COMPANY (US) 1976-07-06 US disclosed