SCHEMBL3091986

SCHEMBL3091986

C#CCC(CO)CO

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
SCHEMBL15967763 0.93
SCHEMBL241106 0.78 ALDH1A1 (0.33)
SCHEMBL23857370 0.77 GRIK1 (0.33)
SCHEMBL23043872 0.75 GRIK1 (0.35)
SCHEMBL23125106 0.75 GRIK1 (0.35)
SCHEMBL13622369 0.72 GRIK1 (0.30)
SCHEMBL16820919 0.71
SCHEMBL5395212 0.71
SCHEMBL16820705 0.71
SCHEMBL27299303 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117586472-B Terylene double-sided coating type flame-retardant waterproof tarpaulin, coating composition and preparation method thereof 广东荣昌纺织实业有限公司 2024-03-15 CN claimed
US-20240124938-A1 VISUAL DETECTION OF PBD INDUCED DNA CROSSLINKS INSERM (INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE) (FR) 2024-04-18 US disclosed
CN-117586472-B Terylene double-sided coating type flame-retardant waterproof tarpaulin, coating composition and preparation method thereof 广东荣昌纺织实业有限公司 2024-03-15 CN disclosed
CN-117586472-A Terylene double-sided coating type flame-retardant waterproof tarpaulin, coating composition and preparation method thereof 广东荣昌纺织实业有限公司 2024-02-23 CN disclosed
CN-115505098-B Zwitterionic polyurethane and preparation method and application thereof 中山大学 2023-07-07 CN disclosed
CN-115505098-A Zwitterionic polyurethane and preparation method and application thereof 中山大学 2022-12-23 CN disclosed
EP-4045511-A1 VISUAL DETECTION OF PBD INDUCED DNA CROSSLINKS INSERM (Institut National de la Santé et de la Recherche Médicale) (FR) 2022-08-24 EP disclosed
WO-2021074392-A1 VISUAL DETECTION OF PBD INDUCED DNA CROSSLINKS INSERM (Institut National de la Santé et de la Recherche Médicale) (FR) 2021-04-22 WO disclosed
CN-106459112-B N-heterocyclic carbene complexes of metalloiminoalkylenes and metallooxoalkylenes and use thereof 斯图加特大学 2020-06-12 CN disclosed
US-9663709-B2 Viscosified treatment fluids comprising polyol derivatized cellulose and methods relating thereto HALLIBURTON ENERGY SERVICES, INC. (US) 2017-05-30 US disclosed
US-20100234482-A1 FUNCTIONALISED POLYURETHANES UNIVERSITEIT GENT (BE) 2010-09-16 US disclosed
US-20100035857-A1 ANTI-HYPERCHOLESTEROLEMIC COMPOUNDS MERCK SHARP & DOHME CORP. 2010-02-11 US disclosed
US-20100035857-A1 ANTI-HYPERCHOLESTEROLEMIC COMPOUNDS MERCK SHARP & DOHME CORP. 2010-02-11 US disclosed
US-20100035857-A1 ANTI-HYPERCHOLESTEROLEMIC COMPOUNDS MERCK SHARP & DOHME CORP. 2010-02-11 US disclosed
EP-2124549-A1 ANTI-HYPERCHOLESTEROLEMIC COMPOUNDS Merck & Co., Inc. (US) 2009-12-02 EP disclosed
WO-2009116090-A2 NOVEL ANTIMICROBIALS PANACEA BIOTEC LIMITED (IN) 2009-09-24 WO disclosed
EP-2009039-A1 Functionalised polyurethanes UNIVERSITEIT GENT (BE) 2008-12-31 EP disclosed
WO-2008085300-A1 ANTI-HYPERCHOLESTEROLEMIC COMPOUNDS MERCK & CO., INC. (US) 2008-07-17 WO disclosed
WO-2008085300-A1 ANTI-HYPERCHOLESTEROLEMIC COMPOUNDS MERCK & CO., INC. (US) 2008-07-17 WO disclosed
US-4492659-A Phospholipid compound BOEHRINGER MANNHEIM GMBH (DE) 1985-01-08 US disclosed