SCHEMBL422046

SCHEMBL422046

CC(=O)C(C)CO

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL11031917 1.00
SCHEMBL105471 1.00
SCHEMBL28286550 0.84 TGFBR1 (0.36)
SCHEMBL28286551 0.83 TGFBR1 (0.31)
SCHEMBL12891365 0.76 ALDH1A1 (0.40)
SCHEMBL9500567 0.76 TSHR (0.44)
SCHEMBL17953984 0.76 ALDH1A1 (0.40)
SCHEMBL13410354 0.76 GABRR1 (0.46)
SCHEMBL15681461 0.75
Acetone SCHEMBL31146574 0.75 GABRR1 (0.46)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119633809-A Composite carrier supported hydrogenation catalyst and application thereof 北京石油化工学院 2025-03-18 CN claimed
CN-119327472-A Low-temperature double-effect rare earth-based nano-sheet catalyst and preparation method and application thereof 中冶长天国际工程有限责任公司 2025-01-21 CN claimed
CN-221245104-U High-efficient apparatus for producing of acetyl n-propanol 淄博九圣化工有限公司 2024-07-02 CN claimed
CN-110052049-B Equipment and method for producing acetyl n-propanol by continuous hydrogenation of 2-methyl furan 山东一诺生物质材料有限公司 2024-02-09 CN claimed
CN-117045851-A Antibacterial liquid spray dressing 上海医妃医药科技有限公司 2023-11-14 CN claimed
CN-113773285-B Method for synthesizing acetyl n-propanol by using solid acid as catalyst 江苏清泉化学股份有限公司 2023-08-18 CN claimed
CN-114316239-B Polycarbonate polyol with side chain containing phosphorus as well as preparation method and application thereof 万华化学集团股份有限公司 2023-08-11 CN claimed
CN-116178120-A Preparation method of acetyl n-propanol 江苏清泉化学股份有限公司 2023-05-30 CN claimed
CN-110862310-B Synthesis method of cyclopropyl methyl ketone 上海生农生化制品股份有限公司 2022-12-27 CN claimed
CN-112717988-B Efficient pollution-free catalyst for preparing acetyl-n-propanol and preparation method and use method thereof 郑州大学 2022-06-24 CN claimed
EP-0913463-A1 Multi-purpose liquid aqueous bleaching compositions THE PROCTER & GAMBLE COMPANY (US) 1999-05-06 EP claimed
EP-0552334-B1 TWO-CYCLE LUBRICANTS AND METHODS OF USING THE SAME LUBRIZOL CORP (US) 1998-08-12 EP claimed
US-5378778-A Liquid catalyst component, catalyst system containing the same, and process for producing ethylene-α-olefin copolymers using the catalyst system SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-01-03 US claimed
US-5264005-A Two-cycle lubricants and methods of using the same THE LUBRIZOL CORPORATION (US) 1993-11-23 US claimed
EP-0552334-A1 TWO-CYCLE LUBRICANTS AND METHODS OF USING THE SAME THE LUBRIZOL CORPORATION (US) 1993-07-28 EP claimed
WO-1993003120-A1 TWO-CYCLE LUBRICANTS AND METHODS OF USING THE SAME THE LUBRIZOL CORPORATION (US) 1993-02-18 WO claimed
EP-0248954-B1 PROCESS FOR REDUCING THE AMOUNT OF DDT-RELATED IMPURITIES IN 1,1-BIS(CHLOROPHENYL)-2,2,2-TRICHLORO-ETHANOL ROHM AND HAAS COMPANY (US) 1992-04-01 EP claimed
EP-0248954-A1 Process for reducing the amount of DDT-related impurities in 1,1-bis(chlorophenyl)-2,2,2-trichloro-ethanol ROHM AND HAAS COMPANY (US) 1987-12-16 EP claimed
US-4705902-A DDTR-free 1,1-bis(chlorophenyl)-2,2,2-trichloroethanol ROHM AND HAAS COMPANY (US) 1987-11-10 US claimed
US-4233462-A BY FORMING A REACTION MIXTURE OF ALKOXY OR HYDROXY KETONES WITH AQUEOUS HYDROGEN PEROXIDE AND A SOURCE OF HYDROGEN IONS; CURING AGENT LAPORTE CHEMICALS LIMITED (GB) 1980-11-11 US claimed