⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3362247 | 0.83 | ALDH1A1 (0.31) | — | |
| SCHEMBL3366118 | 0.78 | — | — | |
| SCHEMBL12087683 | 0.74 | — | — | |
| SCHEMBL2525073 | 0.74 | — | — | |
| SCHEMBL9408165 | 0.74 | — | — | |
| SCHEMBL23927300 | 0.74 | — | — | |
| SCHEMBL10057445 | 0.71 | — | — | |
| SCHEMBL15827466 | 0.71 | — | — | |
| SCHEMBL5168029 | 0.71 | — | — | |
| SCHEMBL2523642 | 0.71 | ADRB2 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20050197514-A1 | Highly branched perfluoroolefins, super-stable perfluoroalkyl radicals and production methods thereof | NATIONAL INSTITUTE OF ADVANCED IND. SCIENCE AND TECH. | 2005-09-08 | — | — | US | disclosed |
| US-20040127756-A1 | Highly branched perfluoroolefins, super-stable perfluoroalkyl radicals and production methods thereof | NATIONAL INSTITUTE OF ADVANCED IND. SCIENCE AND TECH. | 2004-07-01 | — | — | US | disclosed |
| US-6710214-B2 | FOR USE AS POLYMERIZATION CATALYSTS | NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 2004-03-23 | — | — | US | disclosed |
| US-20030097031-A1 | Highly branched perfluoroolefins, super-stable perfluoroalkyl radicals and production methods thereof | NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY | 2003-05-22 | — | — | US | disclosed |
| US-5557020-A | High-purity perfluoro-4-methyl-2-pentene and its preparation and use | HOECHST AKTIENGESELLSCHAFT (DE) | 1996-09-17 | — | — | US | disclosed |
| EP-0588106-B1 | Process for the preparation of hexafluoropropene dimers with a high content of perfluoro-(4-methyl-2-pentene) | HOECHST AG (DE) | 1996-01-24 | — | — | EP | disclosed |
| EP-0602482-B1 | Perfluoro-(4-methyl-2-pentene) of high purity, its preparation and use | HOECHST AG (DE) | 1995-07-26 | — | — | EP | disclosed |
| US-5387728-A | Dimerization of hexafluoropropene in solvent in the presence of a metal fluoride-amine adduct as catalyst | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-02-07 | — | — | US | disclosed |
| EP-0602482-A1 | Perfluoro-(4-methyl-2-pentene) of high purity, its preparation and use | HOECHST AKTIENGESELLSCHAFT (DE) | 1994-06-22 | — | — | EP | disclosed |
| EP-0588106-A1 | Process for the preparation of hexafluoropropene dimers with a high content of perfluoro-(4-methyl-2-pentene) | HOECHST AKTIENGESELLSCHAFT (DE) | 1994-03-23 | — | — | EP | disclosed |