SCHEMBL275582

SCHEMBL275582

CCC(C)CC=S

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
SCHEMBL276265 0.77
SCHEMBL6950521 0.75
SCHEMBL3312249 0.75
SCHEMBL4655169 0.73 TSHR (0.33)
SCHEMBL7229723 0.73
SCHEMBL11280677 0.73
SCHEMBL38447 0.71
SCHEMBL276996 0.71
SCHEMBL10502744 0.71 OPRM1 (0.42)
SCHEMBL276463 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115286500-B Preparation method and composition of acetoacetic acid, 6-ethylthio-3-hepten-2-one and intermediate thereof 山东新和成氨基酸有限公司 2025-03-25 CN claimed
CN-117680064-A Continuous flow preparation method of clethodim intermediate heptenone 浙江工业大学 2024-03-12 CN claimed
CN-117024321-A Total synthesis method of clethodim 首建科技有限公司 2023-11-10 CN claimed
CN-116947718-A Preparation method of high-quality 3-ethylthio butyraldehyde 益丰新材料股份有限公司 2023-10-27 CN claimed
CN-107029636-B Production method and device of 3-ethylthio butyraldehyde 潍坊先达化工有限公司 2023-10-20 CN claimed
CN-116751145-A Method for preparing 6-ethylthio-3-hepten-2-one 首建科技有限公司 2023-09-15 CN claimed
CN-113548990-B Synthesis method of 6-ethylthio-3 hepten-2-one 山东潍坊润丰化工股份有限公司 2023-05-16 CN claimed
CN-115286500-A Preparation method and composition of acetoacetic acid, 6-ethylthio-3-heptylene-2-ketone and intermediate thereof 山东新和成氨基酸有限公司 2022-11-04 CN claimed
CN-114957060-A Synthetic method of 6-ethylthio-3-hepten-2-one 宁夏一帆生物科技有限公司 2022-08-30 CN claimed
CN-114957059-A Green synthesis method of 3-ethylthio butyraldehyde 宁夏汉润生物科技有限公司 2022-08-30 CN claimed
CN-114181123-A Green synthesis method of 6-ethylthio-3 hepten-2-one 宁夏汉润生物科技有限公司 2022-03-15 CN claimed
CN-113548990-A Synthetic method of 6-ethylthio-3 hepten-2-one 山东潍坊润丰化工股份有限公司 2021-10-26 CN claimed
CN-112500322-A Production method of clethodim preparation 安道麦安邦(江苏)有限公司 2021-03-16 CN claimed
CN-210058253-U Production device of 3-ethylthio butyraldehyde 辽宁先达农业科学有限公司 2020-02-14 CN claimed
CN-110627697-A Process for synthesizing cyclohexenone 李德平 2019-12-31 CN claimed
EP-1296556-B1 OPTICALLY PURE(-) CLETHODIM, COMPOSITIONS AND METHODS FOR CONTROLLING PLANT GROWTH COMPRISING THE SAME VALENT USA CORP (US) 2010-09-08 EP claimed
EP-0195053-A1 PROCESS FOR PREPARING 1,3-CYCLOHEXANEDIONE DERIVATIVES AND INTERMEDIATES THEREFOR. CHEVRON RES & TECH (US) 1986-09-24 EP claimed
WO-1986002065-A1 PROCESS FOR PREPARING 1,3-CYCLOHEXANEDIONE DERIVATIVES AND INTERMEDIATES THEREFOR CHEVRON RESEARCH COMPANY (US) 1986-04-10 WO claimed
JP-59042360-A None JP disclosed
US-4355184-A BY REACTING AN ALDEHYDE WITH AN ALKALI METAL SALT OF ACETOACETIC NIPPON SODA COMPANY LIMITED (JP) 1982-10-19 US disclosed