SCHEMBL2990401

SCHEMBL2990401

CCSC(C)CC=CC(C)=O

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 2/20 0.33
CHRNB4 P30926 2/20 0.33
CHRNA3 P32297 2/20 0.33
CHRNA4 P43681 2/20 0.33
MAPT P10636 1/20 0.31

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
SCHEMBL2990400 1.00 CHRNB2 (0.33) CHRNB2CHRNB4CHRNA3CHRNA4MAPT
Toluene SCHEMBL28401481 0.84 GLA (0.38) MAPT
SCHEMBL11291320 0.83 EPHX1 (0.39)
SCHEMBL11291324 0.83 EPHX1 (0.39)
SCHEMBL9298694 0.83 TSHR (0.38) CHRNB2CHRNB4CHRNA3CHRNA4MAPT
SCHEMBL9298692 0.83 TSHR (0.38) CHRNB2CHRNB4CHRNA3CHRNA4MAPT
SCHEMBL29004306 0.82 CHRNB2 (0.32) CHRNB2CHRNB4CHRNA3CHRNA4MAPT
SCHEMBL15823024 0.81 CHRNB2 (0.34) CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL15823027 0.81 CHRNB2 (0.34) CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL21232967 0.80

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 70 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-117024321-A Total synthesis method of clethodim 首建科技有限公司 2023-11-10 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-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-215480664-U Continuous dehydration device in production of 6-ethylthio-3-heptylene-2-ketone 辽宁先达农业科学有限公司 2022-01-11 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-111362850-B Improved process for carrying out cyclization and continuous feed apparatus therefor 内蒙古兰格生物科技有限公司 2021-05-11 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-111362850-A Improved process for carrying out cyclization and continuous feed apparatus therefor 内蒙古兰格生物科技有限公司 2020-07-03 CN claimed
CN-210045242-U Synthetic kettle for producing clethodim intermediate triketone 辽宁先达农业科学有限公司 2020-02-11 CN claimed
EP-0195053-B1 PROCESS FOR PREPARING 1,3-CYCLOHEXANEDIONE DERIVATIVES AND INTERMEDIATES THEREFOR CHEVRON RESEARCH AND TECHNOLOGY COMPANY (US) 1992-02-12 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
CN-121627563-A Method for continuously preparing 6-ethylthio-3-hepten-2-one 福建永晶科技股份有限公司 2026-03-10 CN disclosed
CN-121627563-A Method for continuously preparing 6-ethylthio-3-hepten-2-one 福建永晶科技股份有限公司 2026-03-10 CN disclosed
US-4440566-A Herbicidal substituted 2-(1-(oxyamino)-alkylidene)-cyclohexane-1,3-diones CHEVRON RESEARCH COMPANY (US) 1984-04-03 US 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