SCHEMBL1408587

SCHEMBL1408587

C=C/C=C/C(=O)OC

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
SCHEMBL1408458 1.00
Carbon Monoxide SCHEMBL7008446 0.93 NFE2L2 (0.52)
SCHEMBL17433694 0.91 HCAR2 (0.60)
Dimethyl Maleate SCHEMBL25393211 0.83 NFE2L2 (0.77)
SCHEMBL820946 0.83 NFE2L2 (0.75)
SCHEMBL823097 0.83 NFE2L2 (0.75)
SCHEMBL2944118 0.83 NFE2L2 (0.75)
SCHEMBL821014 0.83 NFE2L2 (0.75)
Biphenyl SCHEMBL27334694 0.82 HCAR2 (0.41)
SCHEMBL8349847 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 122 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4365079-A STEPWISE RECRYSTALLIZATION ATLANTIC RICHFIELD COMPANY (US) 1982-12-21 US claimed
US-4299976-A PALLADIUM COMPLEX CATALYST ATLANTIC RICHFIELD COMPANY (US) 1981-11-10 US claimed
US-4236023-A Preparation of unsaturated monoesters by the catalytic oxidative carbonylation of diolefins with an enol ether or 1-alkoxycycloalkene ATLANTIC RICHFIELD COMPANY (US) 1980-11-25 US claimed
US-4195184-A Preparation of unsaturated monoesters by catalytic oxidative carbonylation of diolefins ATLANTIC RICHFIELD COMPANY (US) 1980-03-25 US claimed
WO-2025215536-A1 MACROCYCLIC PANRAS INHIBITORS FOR THE TREATMENT OF CANCER NOVARTIS AG (CH) 2025-10-16 WO disclosed
US-20250250370-A1 METHACRYLATE-CONTAINING COMPOSITION, METHOD FOR PRODUCING METHACRYLIC ESTER, POLYMERIZABLE COMPOSITION, AND METHOD FOR PRODUCING METHACRYLIC ACID POLYMER MITSUBISHI CHEMICAL CORPORATION (JP) 2025-08-07 US disclosed
WO-2024090544-A1 METHACRYLATE-CONTAINING COMPOSITION, METHOD FOR PRODUCING METHACRYLIC ESTER, POLYMERIZABLE COMPOSITION, AND METHOD FOR PRODUCING METHACRYLIC ACID POLYMER 三菱ケミカル株式会社 2024-05-02 WO disclosed
CN-117810530-A In-situ polymerization high-voltage-resistant semi-solid electrolyte, preparation method thereof and lithium metal semi-solid battery 四川启睿克科技有限公司 2024-04-02 CN disclosed
US-20230287464-A1 MICROORGANISMS AND METHODS FOR THE PRODUCTION OF BUTADIENE USING ACETYL-COA GENOMATICA INC (US) 2023-09-14 US disclosed
US-11371063-B2 Microorganisms and methods for the production of butadiene using acetyl-coA GENOMATICA, INC. (US) 2022-06-28 US disclosed
US-11111206-B2 Monomers and polymers formed thereby REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2021-09-07 US disclosed
CN-112714767-A Boron-containing conjugated polyene compound, process for producing the same, and process for producing conjugated polyene compound 国立大学法人东京农工大学 2021-04-27 CN disclosed
US-4365079-A STEPWISE RECRYSTALLIZATION ATLANTIC RICHFIELD COMPANY (US) 1982-12-21 US disclosed
US-4341781-A HYPOTENSIVE AGENTS HOFFMANN-LA ROCHE INC. (US) 1982-07-27 US disclosed
US-4318860-A REACTING BUTADIENE AND METHYL 2,4-PENTADIENOATE, PALLADIUM COMPLEX CATALYST ATLANTIC RICHFIELD COMPANY (US) 1982-03-09 US disclosed
US-4299976-A PALLADIUM COMPLEX CATALYST ATLANTIC RICHFIELD COMPANY (US) 1981-11-10 US disclosed
US-4299976-A PALLADIUM COMPLEX CATALYST ATLANTIC RICHFIELD COMPANY (US) 1981-11-10 US disclosed
US-4236023-A Preparation of unsaturated monoesters by the catalytic oxidative carbonylation of diolefins with an enol ether or 1-alkoxycycloalkene ATLANTIC RICHFIELD COMPANY (US) 1980-11-25 US disclosed
US-4195184-A Preparation of unsaturated monoesters by catalytic oxidative carbonylation of diolefins ATLANTIC RICHFIELD COMPANY (US) 1980-03-25 US disclosed
US-4189599-A Preparation of dimethyl adipate by the hydrogenation of dimethyl hex-3-endioate ATLANTIC RICHFIELD COMPANY (US) 1980-02-19 US disclosed