SCHEMBL2163255

SCHEMBL2163255

CC(C)=C(C)C=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
SCHEMBL8465936 0.82
SCHEMBL9512225 0.82
SCHEMBL8324142 0.82
SCHEMBL10716898 0.72
SCHEMBL14255030 0.72 ALDH1A1 (0.31)
SCHEMBL28284869 0.72
SCHEMBL10264887 0.72
SCHEMBL13927610 0.69
SCHEMBL1823756 0.69
SCHEMBL1823754 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114685296-B Preparation method of polyether intermediate containing aldehyde group and amine group and application of polyether intermediate in phosphate water reducer 南京博特新材料有限公司 2025-02-25 CN claimed
CN-109310982-B Composition for removing sulfur-containing compounds 株式会社可乐丽(JP) 2023-01-13 CN claimed
CN-114685296-A Preparation method of polyether intermediate containing aldehyde group and amino group and application of polyether intermediate in phosphate water reducing agent 南京博特新材料有限公司 2022-07-01 CN claimed
US-11291947-B2 Composition for removing sulfur-containing compound KURARAY CO., LTD. (JP) 2022-04-05 US claimed
EP-2953920-B1 PROCESS FOR THE ISOMERISATION OF AN EXO DOUBLE BOND FIRMENICH & CIE (CH) 2018-07-18 EP claimed
CN-104995165-B Method for isomerising external double bonds 弗门尼舍有限公司 2017-09-15 CN claimed
US-9416082-B2 Process for the isomerisation of an exo double bond FIRMENICH SA (CH) 2016-08-16 US claimed
US-20160060200-A1 PROCESS FOR THE ISOMERISATION OF AN EXO DOUBLE BOND FIRMENICH SA (CH) 2016-03-03 US claimed
EP-2953920-A1 PROCESS FOR THE ISOMERISATION OF AN EXO DOUBLE BOND Firmenich SA (CH) 2015-12-16 EP claimed
WO-2014122263-A1 PROCESS FOR THE ISOMERISATION OF AN EXO DOUBLE BOND FIRMENICH SA (CH) 2014-08-14 WO claimed
US-4021411-A Production of high molecular weight α,β-unsaturated aldehydes BADISCHE ANILIN- & SODA-FABRIK AKTIENGESELLSCHAFT (DT) 1977-05-03 US claimed
WO-2025059040-A1 MUTANT KRAS MODULATORS AND USES THEREOF NEWAVE PHARMACEUTICAL INC. (US) 2025-03-20 WO disclosed
CN-114685296-B Preparation method of polyether intermediate containing aldehyde group and amine group and application of polyether intermediate in phosphate water reducer 南京博特新材料有限公司 2025-02-25 CN disclosed
CN-119431099-A Conjugated crosslinking monomer, tackifier for solid-free drilling fluid, and preparation method and application thereof 中石化石油工程技术服务股份有限公司 2025-02-14 CN disclosed
CN-119176781-A Conjugated diene ionic liquid and preparation method and application thereof 中国石油化工股份有限公司 2024-12-24 CN disclosed
US-4009171-A ANTAGONISTS OF NARCOTIC ANALGESICS STERLING DRUG INC. (US) 1977-02-22 US disclosed
US-4009196-A HYPOTENSIVE AGENTS, BRONCHODILATORS, PROSTAGLANDIN ANALOGS TEIJIN LIMITED (JA) 1977-02-22 US disclosed
US-4007089-A Method for binding biologically active compounds NELSON RESEARCH & DEVELOPMENT COMPANY (US) 1977-02-08 US disclosed
US-3965193-A Production of high molecular weight α,β-unsaturated aldehydes BADISCHE ANILIN- & SODA-FABRIK AKTIENGESELLSCHAFT (DT) 1976-06-22 US disclosed
US-3933861-A CODIMERIZATION OF AN ALKENE OXIDE WITH AN ALKENE IN A NOBLE METAL COMPOUND CATALYST, IODINE PROMOTER CHEVRON RESEARCH COMPANY (US) 1976-01-20 US disclosed