SCHEMBL1821089

SCHEMBL1821089

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

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
Pyrrole SCHEMBL11246788 0.85 HMGCR (0.41)
SCHEMBL27324574 0.82 HMGCR (0.46)
SCHEMBL6586523 0.80 TET2 (0.35)
SCHEMBL6722305 0.79
SCHEMBL10683916 0.79
SCHEMBL6717964 0.79
SCHEMBL502136 0.77 HMGCR (0.46)
SCHEMBL15057710 0.77
SCHEMBL7917810 0.77 HMGCR (0.46)
SCHEMBL14942954 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118290312-A Hydrophobic monomer and preparation method thereof, polymer gel and preparation method and application thereof, and plugging material and application thereof 中国石油化工股份有限公司 2024-07-05 CN claimed
CN-116769098-A Functionalized particle collector, preparation method thereof and application thereof in micro-fine cassiterite flotation 中南大学 2023-09-19 CN claimed
CN-114605311-B Process for the preparation of intermediates of the drug nitratrelvir useful in the treatment of novel coronaviruses 南京桦冠生物技术有限公司 2022-07-15 CN claimed
CN-114605311-A Process for the preparation of intermediates of the drug nitratrelvir for the treatment of a novel coronavirus 南京桦冠生物技术有限公司 2022-06-10 CN claimed
WO-2022031654-A1 HYDROSILATION CURABLE COMPOSITIONS Henkel IP & Holding GmbH (DE) 2022-02-10 WO claimed
US-20020161244-A1 Preparation of cis-6,6-dimethyl-3-oxa-bicyclo(3.1.0)hexan-2-one LEVIN DANIEL (GB) 2002-10-31 US claimed
EP-0566643-B1 PROCESS FOR PREPARING HALOGENATED COMPOUNDS ZENECA LTD (GB) 1997-05-28 EP claimed
US-5189202-A From isoprenol, or mixture of isoprenol with prenol LUCKY, LTD. (KR) 1993-02-23 US claimed
EP-0019374-B1 BY-PRODUCT RECYCLING PROCESS IN THE PRODUCTION OF LOWER ALKYL 3.3-DIMETHYL-4-PENTENOATE ESTERS FMC Corporation (US) 1984-07-04 EP claimed
EP-0019374-A1 By-product recycling process in the production of lower alkyl 3.3-dimethyl-4-pentenoate esters FMC Corporation (US) 1980-11-26 EP claimed
JP-1063542-A None JP disclosed
JP-52083412-A None JP disclosed
JP-52083413-A None JP disclosed
JP-52083411-A None JP disclosed
CN-116199806-B Coordination precipitation polymerization method for olefin polymerization and obtained polyolefin 中国石油化工股份有限公司 2025-05-06 CN disclosed
EP-0004070-A1 2-Methylene-3-(3-methyl-2-butenyl)-oxazolidines(II), process for their preparation, intermediates required for this process, use of II for the preparation of 2-(2,2-dimethyl-3-butene-1-yl)-2-oxazolines(I) BAYER AG (DE) 1979-09-19 EP disclosed
EP-0000390-A1 Derivatives of 2-(2,2-Dihalogenvinyl)-3,3-dimethyl-cyclopropane carboxylic acid and process for preparing them BAYER AG (DE) 1979-01-24 EP disclosed
JP-S5283411-A PREPARATION OF 3,3-DIMETHYL-4-PENTENOIC ACID AND ITS DERIVATIVES KURARAY CO LTD 1977-07-12 JP disclosed
JP-S5283412-A PREPARATION OF 3,3-DIMETHYL-4-PENTENOIC ACIDS KURARAY CO LTD 1977-07-12 JP disclosed
JP-S5283413-A PREPARATION OF 3,3-DIMETHYL-4-PENTENOIC ACID OR ITS ESTERS KURARAY CO LTD 1977-07-12 JP disclosed