SCHEMBL959385

SCHEMBL959385

CC(C)OB(OC(C)C)OC(C)C.[KH]

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
SCHEMBL3261343 0.96
SCHEMBL38188 0.96
SCHEMBL4229276 0.92
SCHEMBL10535002 0.92
Potassium SCHEMBL30607080 0.92
Lithium SCHEMBL30271121 0.92
SCHEMBL10524134 0.92
Ammonia Solution, Strong SCHEMBL10617791 0.92
Water SCHEMBL27652010 0.92
Lithium Ion SCHEMBL10526254 0.88

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117756720-B Polymerizable quaternary ammonium salt antibacterial agent, preparation thereof and application thereof in synthesis of antibacterial polyester 东方电气股份有限公司 2024-09-13 CN claimed
CN-117756720-A Polymerizable quaternary ammonium salt antibacterial agent, preparation thereof and application thereof in synthesis of antibacterial polyester 东方电气股份有限公司 2024-03-26 CN claimed
CN-112778151-B Preparation method of 5-amino-2, 4, 6-triiodo-1, 3-phthalic acid impurity 浙江司太立制药股份有限公司 2022-11-25 CN claimed
CN-112939847-B Method for preparing moxifloxacin intermediate (S, S) -2, 8-diazabicyclo [4,3,0] nonane 台州市生物医化产业研究院有限公司 2022-05-13 CN claimed
CN-112920184-B Method for preparing moxifloxacin intermediate (S, S) -2, 8-diazabicyclo [4,3,0] nonane 台州市生物医化产业研究院有限公司 2022-03-01 CN claimed
CN-112778151-A Preparation method of 5-amino-2, 4, 6-triiodo-1, 3-phthalic acid impurity 浙江司太立制药股份有限公司 2021-05-11 CN claimed
CN-112062697-A M-benzene polyphenol derivative and preparation method thereof 上海特化医药科技有限公司 2020-12-11 CN claimed
EP-2872246-A2 FUEL CELL APPARATUS, COMPOSITION AND HYDROGEN GENERATOR Prometheus Wireless Limited (GB) 2015-05-20 EP claimed
WO-2014013246-A2 FUEL CELL APPARATUS, COMPOSITION AND HYDROGEN GENERATOR PROMETHEUS WIRELESS LIMITED (GB) 2014-01-23 WO claimed
EP-1555991-B1 AGENT AND METHOD FOR PERMANENTLY SHAPING HAIR, BASED ON ORGANIC BORON HYDRIDE DERIVATIVES WELLA AG (DE) 2006-12-06 EP claimed
US-20050214237-A1 Agent and method for permanent hair deformation based on organic borohysride derivatives WELLA AKTIENGESELLSCHAFT (DE) 2005-09-29 US claimed
US-5164503-A Reduction, hydrolysis GLAXO GROUP LIMITED (GB) 1992-11-17 US claimed
CN-117756720-B Polymerizable quaternary ammonium salt antibacterial agent, preparation thereof and application thereof in synthesis of antibacterial polyester 东方电气股份有限公司 2024-09-13 CN disclosed
CN-117756720-A Polymerizable quaternary ammonium salt antibacterial agent, preparation thereof and application thereof in synthesis of antibacterial polyester 东方电气股份有限公司 2024-03-26 CN disclosed
CN-112778151-B Preparation method of 5-amino-2, 4, 6-triiodo-1, 3-phthalic acid impurity 浙江司太立制药股份有限公司 2022-11-25 CN disclosed
WO-2022166440-A1 METHOD FOR PREPARING MOXIFLOXACIN INTERMEDIATE, (S,S)-2,8-DIAZABICYCLO[4,3,0]NONANE 台州市生物医化产业研究院有限公司 2022-08-11 WO disclosed
US-4540819-A Process for preparing secondary amines SMITHKLINE BECKMAN CORPORATION (US) 1985-09-10 US disclosed
EP-0125053-A1 Process for preparing secondary amines SMITHKLINE BECKMAN CORPORATION (US) 1984-11-14 EP disclosed
US-4436903-A Process for the production of 7 β-substituted-3-unsubstituted-3-cephem-4-carboxylic acid compounds CIBA-GEIGY CORPORATION (US) 1984-03-13 US disclosed
EP-0069447-A2 Aminocyclopentanol acids and esters and their preparation and pharmaceutical formulation GLAXO GROUP LIMITED (GB) 1983-01-12 EP disclosed