SCHEMBL1899467

SCHEMBL1899467

COC(=O)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
SCHEMBL10962562 1.00 ALDH1A1 (0.35)
SCHEMBL11351014 1.00 ALDH1A1 (0.35)
SCHEMBL25706 0.87 ALDH1A1 (0.44)
SCHEMBL11356961 0.78 ALDH1A1 (0.38)
SCHEMBL10136741 0.77
SCHEMBL16504413 0.75
SCHEMBL2939248 0.75 ALDH1A1 (0.39)
SCHEMBL12174598 0.74 ALDH1A1 (0.33)
SCHEMBL27905777 0.74
SCHEMBL7146408 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114213422-A Superphanes super-sweet compound and preparation method and application thereof 湖南大学 2022-03-22 CN claimed
US-20020197262-A1 Photoimmunotherapies for cancer using photosensitizer immunoconjugates and combination therapies NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2002-12-26 US claimed
CN-1096462-C New substituted 7, 12 -dioxabenz [a] anthracene compounds, process for preparing them and pharmaceutical compositions containing them SEVILL LTD (FR) 2002-12-18 CN claimed
CN-1182087-A New substituted 7, 12 -dioxabenz [a] anthracene compounds, process for preparing them and pharmaceutical compositions containing them ADIR (FR) 1998-05-20 CN claimed
US-4070259-A DIELS-ALDER REACTION PRODUCT, PAINTS, VARNISHES, INKS U C B, SOCIETE ANONYME (BE) 1978-01-24 US claimed
US-12065418-B2 Biomass conversion NEDERLANDSE ORGANISATIE VOOR TOEGEPAST-NATUURWETENSCHAPPELIJK ONDERZOEK TNO (NL) 2024-08-20 US disclosed
US-11981674-B1 7-isopropyl 1-ethyl/methyl 3-(substituted benzoyl)-2-substituted indolizine-1,7-dicarboxylates as larvicidal agents King Faisal University (SA) 2024-05-14 US disclosed
US-11981673-B1 7-isopropyl 1,2-dimethyl 3-(substituted benzoyl)indolizine-1,2,7 tricarboxylates as adenosine receptor active compounds King Faisal University (SA) 2024-05-14 US disclosed
WO-2024070622-A1 CARBOXYL GROUP-CONTAINING ACRYLIC RUBBER COMPOSITION AND CROSSLINKED PRODUCT THEREOF 株式会社大阪ソーダ 2024-04-04 WO disclosed
US-11807640-B1 7-isopropyl 1-ethyl/methyl 3-(substituted benzoyl)-2-substituted indolizine-1,7-dicarboxylates as anti-tubercular agents King Faisal University (SA) 2023-11-07 US disclosed
EP-4223511-A1 CARBOXYL GROUP-CONTAINING ACRYLIC RUBBER COMPOSITION AND MULTILAYER BODY Osaka Soda Co., Ltd. (JP) 2023-08-09 EP disclosed
CN-116056886-A Carboxyl group-containing acrylic rubber composition and laminate 株式会社大阪曹达 2023-05-02 CN disclosed
EP-0302633-A2 Beta-lactam compound, process for preparing the same, intermediate for synthesis of the same and medicinal composition for bacterially infectious disease therapy containing the same SANKEI PHARMACEUTICAL COMPANY LIMITED (JP) 1989-02-08 EP disclosed
EP-0111286-B1 NOVEL BETA-LACTAM DERIVATIVES AND PROCESS FOR PRODUCTION THEREOF Sanraku Incorporated (JP) 1988-03-02 EP disclosed
US-4558069-A TREATMENT OF SKIN DISORDERS GROUPEMENT D'INTERET ECONOMIQUE DIT: CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES C.I.R.D. (FR) 1985-12-10 US disclosed
US-4517127-A β-Lactam derivatives and process for production thereof SANRAKU-OCEAN CO., LTD. (JP) 1985-05-14 US disclosed
US-4465688-A FOR TREATMENT OF SKIN DISORDERS GROUPEMENT D'INTERET ECONOMIQUE CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES C.I.R.D. (FR) 1984-08-14 US disclosed
US-4464301-A FOR TREATMENT OF PSORIASIS GROUPEMENT D'INTERET ECONOMIQUE CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES C.I.R.D. (FR) 1984-08-07 US disclosed
EP-0111286-A1 Novel beta-lactam derivatives and process for production thereof Sanraku Incorporated (JP) 1984-06-20 EP disclosed
US-4070259-A DIELS-ALDER REACTION PRODUCT, PAINTS, VARNISHES, INKS U C B, SOCIETE ANONYME (BE) 1978-01-24 US disclosed