SCHEMBL4412

SCHEMBL4412

CCOC(=O)C=[N+]=[N-]

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
SCHEMBL28285089 0.98
Alcohol SCHEMBL28357108 0.96 HCAR2 (0.43)
Methylene Chloride SCHEMBL27697374 0.94 HCAR2 (0.42)
Acetic Acid SCHEMBL28563384 0.94 HCAR2 (0.47)
Ethyl Acetate SCHEMBL10781172 0.92 ALDH1A1 (0.56)
1,2-Dichloroethane SCHEMBL28431339 0.92 HCAR2 (0.41)
Ethylenediamine SCHEMBL15322398 0.92 HCAR2 (0.41)
SCHEMBL28343786 0.90 HCAR2 (0.39)
SCHEMBL2743750 0.86 GAA (0.41)
O-Xylene SCHEMBL28512915 0.85 CYP1A2 (0.44)

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

Appears in 6625 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122013597-A Flexible ceramic nanofiber paper based on linear inorganic molecular chain and preparation method and application thereof 东华大学 2026-05-12 CN claimed
CN-119656720-B Preparation method of composite filter material for purifying incineration tail gas 台州市皓天产业用布股份有限公司 2025-04-18 CN claimed
CN-119656720-A Preparation method of composite filter material for purifying incineration tail gas 台州市皓天产业用布股份有限公司 2025-03-21 CN claimed
US-20250092008-A1 PROCESS FOR MAKING AN EP4 ANTAGONIST ONO PHARMACEUTICAL CO., LTD. (JP) 2025-03-20 US claimed
CN-119330826-A Method for efficiently preparing ethyl chrysanthemate by using Beta/CuCl nano molecular sieve catalyst 临沂广辰化工有限公司 2025-01-21 CN claimed
CN-119176776-A Beta-lactamase inhibitor intermediate and preparation method thereof 上海皓元医药股份有限公司 2024-12-24 CN claimed
CN-118930436-A Method for catalyzing coupling reaction of nitro compound and diazo compound by using corrinyl ring-containing small molecular compound 北京化工大学 2024-11-12 CN claimed
CN-118652168-A Preparation method of 2, 3-tetramethyl cyclopropane carboxylic acid 大连凯飞化学股份有限公司 2024-09-17 CN claimed
CN-118619889-A Synthesis method of 1,2, 3-triazole-4-ethyl formate 南通药明康德医药科技有限公司 2024-09-10 CN claimed
CN-114751867-B Feed additive and preparation method and application thereof 重庆市万虹饲料有限公司 2024-09-06 CN claimed
US-5175311-A Reacting olefin with carbene precursor RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1992-12-29 US claimed
US-H1064-H Using diazo compound SHELL OIL COMPANY (US) 1992-06-02 US claimed
WO-1991014672-A1 CHIRAL CATALYSTS FOR ENANTIOSELECTIVE SYNTHESIS RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1991-10-03 WO claimed
EP-0363994-A2 (2R,3S,4S)-alpha-(carboxycyclopropyl)glycine SUNTORY LIMITED (JP) 1990-04-18 EP claimed
US-4709085-A Cyclopropanation process E. I. DU PONT DE NEMOURS AND COMPANY (US) 1987-11-24 US claimed
CN-86100254-A The method for preparing tertiary amine compounds 1986-10-08 CN claimed
US-4605755-A Preparation of 1,1-diphenyl-2-carboethoxycyclopropane STAUFFER CHEMICAL COMPANY (US) 1986-08-12 US claimed
EP-0188887-A1 Tertiary amine compounds IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-07-30 EP claimed
US-4332962-A RHODIUM COMPOUND AS CATALYST FOR CYCLIZATION OF A PENTADIENE IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1982-06-01 US claimed
US-4016204-A ISOMERIZING ETHYL-2-PHENYL-CYCLOPROPANE CARBOXYLATE NELSON RESEARCH & DEVELOPMENT COMPANY (US) 1977-04-05 US claimed