SCHEMBL135878

SCHEMBL135878

CCC(CO)CC(C)C

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
SCHEMBL12345302 1.00
SCHEMBL10927040 0.97 TRPA1 (0.47)
SCHEMBL10786182 0.97 TRPA1 (0.47)
SCHEMBL3199611 0.87
SCHEMBL14302635 0.87 TRPA1 (0.44)
SCHEMBL17464871 0.85 TRPA1 (0.42)
SCHEMBL246160 0.84 ALDH1A1 (0.52)
SCHEMBL15158732 0.84 TSHR (0.53)
SCHEMBL29322852 0.83 TRPA1 (0.41)
SCHEMBL21332953 0.81 ALDH1A1 (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120009438-A Detection method of novel disinfection byproducts in aquatic products 舟山市食品药品检验检测研究院 2025-05-16 CN claimed
US-20250003909-A1 PORTABLE AIR SAMPLING SYSTEM FOR DETECTING VOLATILE ORGANIC COMPOUNDS THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK 2025-01-02 US claimed
EP-3619219-B1 LOW-VISCOSITY SOLUTIONS OF ALKALINE-EARTH METAL ALKOXIDES IN APROTIC SOLVENTS, METHOD FOR THE PRODUCTION OF SAME AND USE FOR THE PRODUCTION OF ZIEGLER-NATTA CATALYSTS ALBEMARLE GERMANY GMBH (DE) 2023-11-01 EP claimed
US-11230519-B2 Low-viscosity solutions of alkaline-earth metal alkoxides in aprotic solvents, method for the production of same and use for the production of ziegler-natta catalysts ALBEMARLE GERMANY GMBH 2022-01-25 US claimed
EP-3846691-A2 SYSTEM FOR DETECTION OF VOLATILE ORGANIC COMPOUNDS (VOC) IN EXHALED BREATH FOR HEALTH MONITORING Kozhnosys Private Limited (IN) 2021-07-14 EP claimed
US-20210186367-A1 SYSTEM FOR DETECTION OF VOLATILE ORGANIC COMPOUNDS (VOC) IN EXHALED BREATH FOR HEALTH MONITORING KOZHNOSYS PRIVATE LIMITED (IN) 2021-06-24 US claimed
EP-2912004-B9 LOW-VISCOSITY CONCENTRATED SOLUTIONS OF ALKALINE EARTH METAL ALKOXIDES IN APROTIC SOLVENTS AND PROCESSES FOR PREPARATION THEREOF Rockwood Lithium GmbH (DE) 2020-12-23 EP claimed
CN-111648038-A Melt-blown cloth and application thereof in protective mask 升欣(上海)纺织品科技有限公司 2020-09-11 CN claimed
CN-107027310-B Low viscosity solutions of alkaline earth metal alkoxides in aprotic solvents, method for the production thereof and use for producing ziegler-natta catalysts 雅宝德国有限责任公司 2020-05-01 CN claimed
US-20200123086-A1 Low-Viscosity Solutions of Alkaline-Earth Metal Alkoxides In Aprotic Solvents, Method for the Production of Same and Use for the Production of Ziegler-Natta Catalysts Rockwood Lithium GmbH (DE) 2020-04-23 US claimed
US-RE34093-E Latex emulsion or dispersion of a vinyl homo or copolymer and an isocyanate which has undergone at least partial reaction wi th an alcohol ASHLAND INC. (A KENTUCKY CORPORATION) 1992-10-06 US claimed
US-4820672-A REACTING MAGNESIUM OR ORGANOMAGNESIUM COMPOUNDS, HYDROGEN CHLORIDE, CHLOROALCOHOL, BETA-ALKYL SUBSTITUTED ALCOHOLS; POLY CAT OR SUPPORTS LITHIUM CORPORATION OF AMERICA (US) 1989-04-11 US claimed
US-4792640-A REACTING ACTIVATED MAGNESIUM METAL WITH ALKYL HALIDE, REACTING PRODUCT WITH ALCOHOL LITHIUM CORPORATION OF AMERICA (US) 1988-12-20 US claimed
EP-0242801-A2 Hydrocarbyloxy magnesium halides LITHIUM CORPORATION OF AMERICA (US) 1987-10-28 EP claimed
US-4634786-A INTERMEDIATES FOR ZIEGLER CATALYSTS LITHIUM CORPORATION OF AMERICA (US) 1987-01-06 US claimed
EP-0191993-A1 Improved synthesis of molybdenum/alcohol complexes useful as epoxidation catalysts TEXACO DEVELOPMENT CORPORATION (US) 1986-08-27 EP claimed
EP-0162908-A4 PREPARATION OF ALKALINE EARTH METAL ORGANOMETALLIC COMPOUNDS. LITHIUM CORP (US) 1986-04-15 EP claimed
EP-0162908-A1 PREPARATION OF ALKALINE EARTH METAL ORGANOMETALLIC COMPOUNDS LITHIUM CORPORATION OF AMERICA (US) 1985-12-04 EP claimed
US-4555498-A Preparation of certain alkaline earth metal organometallic compounds LITHIUM CORPORATION OF AMERICA (US) 1985-11-26 US claimed
WO-1985002176-A1 PREPARATION OF ALKALINE EARTH METAL ORGANOMETALLIC COMPOUNDS LITHIUM CORPORATION OF AMERICA (US) 1985-05-23 WO claimed