⚠ 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL10457293 | 1.00 | — | — | |
| SCHEMBL11456995 | 1.00 | — | — | |
| SCHEMBL7794325 | 0.89 | ALDH1A1 (0.50) | — | |
| SCHEMBL10952289 | 0.79 | ALDH1A1 (0.52) | — | |
| SCHEMBL10952287 | 0.79 | ALDH1A1 (0.52) | — | |
| SCHEMBL28352153 | 0.79 | ALDH1A1 (0.52) | — | |
| SCHEMBL873402 | 0.79 | — | — | |
| SCHEMBL873403 | 0.79 | — | — | |
| SCHEMBL2313038 | 0.78 | PTGS1 (0.67) | — | |
| SCHEMBL11842623 | 0.78 | PTGS1 (0.67) | — |
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 51 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4010078-A1 | COMPOSITIONS AND METHODS OF ENHANCING OPIOID RECEPTOR ENGAGEMENT BY OPIOID HEXADIENOATES AND OPTIONALLY SUBSTITUTED HEXADIENOATES | Kappa-Pharma LLC (US) | 2022-06-15 | — | — | EP | claimed |
| US-5316572-A | Portland cement, water, polymer, water-reducing agent | NMB LTD. (JP) | 1994-05-31 | — | — | US | claimed |
| JP-62079268-A | — | — | None | — | — | JP | disclosed |
| US-11851439-B2 | Compositions and methods of use for opioid hexadienoates and optionally substituted hexadienoates | Kappa-Pharma LLC (US) | 2023-12-26 | — | — | US | disclosed |
| CN-116607324-A | Water-repellent and oil-repellent composition for nonwoven fabric and nonwoven fabric product | 大金工业株式会社 | 2023-08-18 | — | — | CN | disclosed |
| CN-106459449-B | Styrene-based biaxially stretched sheet, biaxially stretched sheet with antifogging agent layer, packaging container, and heat cooking method | 电化株式会社 | 2021-04-27 | — | — | CN | disclosed |
| CN-104592019-B | The method for preparing (E) -2- isopropyl -5- methyl -2,4- hexadienyl acetic acid esters | 信越化学工业株式会社 | 2019-01-25 | — | — | CN | disclosed |
| EP-2757135-B1 | Method of bonding parts to a vehicle by an acrylic foam tape | 3M INNOVATIVE PROPERTIES CO (US) | 2017-11-29 | — | — | EP | disclosed |
| EP-2576799-B1 | PRODUCTION OF FATTY ACIDS BY HETEROLOGOUS EXPRESSION OF GENE CLUSTERS FROM MYXOBACTERIA | UNIV SAARLAND (DE) | 2017-04-26 | — | — | EP | disclosed |
| US-9574215-B2 | Production of fatty acids by heterologous expression of gene clusters from myxobacteria | UNIVERSITAT DES SAARLANDES (DE) | 2017-02-21 | — | — | US | disclosed |
| US-20160017388-A1 | PRODUCTION OF FATTY ACIDS BY HETEROLOGOUS EXPRESSION OF GENE CLUSTERS FROM MYXOBACTERIA | UNIV SAARLAND (DE) | 2016-01-21 | — | — | US | disclosed |
| US-5149522-A | Polyquaternary salt, sulfosuccinate, lauryl alcohol diglycol ether sulfate | WELLA AKTIENGESELLSCHAFT (DE) | 1992-09-22 | — | — | US | disclosed |
| US-5100656-A | Formic Acid Salt, Sorbic Acid or Salts, Surfactant, Phosphoric Acid or Organic Acid | WELLA AKTIENGESELLSCHAFT (DE) | 1992-03-31 | — | — | US | disclosed |
| US-4971784-A | DETERGENTS, ANTISEPTICS, BACTERICIDES, FUNGICIDES | WELLA AKTIENGESELLSCHAFT (DE) | 1990-11-20 | — | — | US | disclosed |
| EP-0161118-B1 | FLEXIBLE POLYVINYLIDENE FLUORIDE COMPOSITIONS, AND THEIR USE, ESPECIALLY IN MAKING FLEXIBLE TUBES | Institut Français du Pétrole (FR) | 1988-09-14 | — | — | EP | disclosed |
| JP-S6279268-A | BITUMINOUS COMPOSITION | IDEMITSU PETROCHEM CO LTD | 1987-04-11 | — | — | JP | disclosed |
| EP-0161118-A1 | Flexible polyvinylidene fluoride compositions, and their use, especially in making flexible tubes | Institut Français du Pétrole (FR) | 1985-11-13 | — | — | EP | disclosed |
| US-4233129-A | Process of preparation of alkyl esters of dl cis chrysanthemic acid | ROUSSEL UCLAF (FR) | 1980-11-11 | — | — | US | disclosed |
| US-4167616-A | Polymerization with diborane adducts or oligomers of boron-containing monomers | ROHM AND HAAS COMPANY (US) | 1979-09-11 | — | — | US | disclosed |
| JP-S06279268-A | — | — | 0001-01-01 | — | — | JP | disclosed |