⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6655930 | 0.96 | — | — | |
| SCHEMBL11868782 | 0.74 | — | — | |
| SCHEMBL29140269 | 0.74 | — | — | |
| SCHEMBL169861 | 0.67 | — | — | |
| SCHEMBL11051021 | 0.67 | — | — | |
| Butadiene SCHEMBL28200898 | 0.65 | — | — | |
| SCHEMBL6520355 | 0.65 | — | — | |
| SCHEMBL4665804 | 0.59 | — | — | |
| Butadiene SCHEMBL28185237 | 0.59 | ALDH1A1 (0.33) | — | |
| SCHEMBL4665561 | 0.58 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0071622-A1 | PAINT OR COATING COMPOSITION AND METHOD FOR PAINTING OR COATING SURFACES | HEMPEL TECHNOLOGY A/S (DK) | 1983-02-16 | — | — | EP | claimed |
| WO-1982002709-A1 | PAINT OR COATING COMPOSITION AND METHOD FOR PAINTING OR COATING SURFACES | CONRADSEN NIELS | 1982-08-19 | — | — | WO | claimed |
| CN-116162388-A | Barrier composition | 巴斯夫欧洲公司 | 2023-05-26 | — | — | CN | disclosed |
| CN-107075400-A | Thermally conductive grease based on hyperbranched olefin fluids | 陶氏环球技术有限责任公司 | 2017-08-18 | — | — | CN | disclosed |
| US-20080193700-A1 | Metal Chelates and Their Use in Optical Recording Media Having High Storage Capacity | CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) | 2008-08-14 | — | — | US | disclosed |
| WO-1996029201-A1 | INORGANIC CERAMIC PAPER, ITS METHOD OF MANUFACTURE AND ARTICLES PRODUCED THEREFROM | UNIFRAX CORPORATION (US) | 1996-09-26 | — | — | WO | disclosed |
| WO-1996029315-A2 | IMIDAZOLE DERIVATIVES AS HISTAMINE RECEPTOR H3 (ANT)AGONISTS | INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (FR) | 1996-09-26 | — | — | WO | disclosed |
| US-4459334-A | Composite building panel | RMAX, INC. (US) | 1984-07-10 | — | — | US | disclosed |
| EP-0071622-A1 | PAINT OR COATING COMPOSITION AND METHOD FOR PAINTING OR COATING SURFACES | HEMPEL TECHNOLOGY A/S (DK) | 1983-02-16 | — | — | EP | disclosed |
| WO-1982002709-A1 | PAINT OR COATING COMPOSITION AND METHOD FOR PAINTING OR COATING SURFACES | CONRADSEN NIELS | 1982-08-19 | — | — | WO | disclosed |