⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2047338 | 0.74 | — | — | |
| SCHEMBL8145941 | 0.73 | — | — | |
| SCHEMBL9797526 | 0.71 | MEN1 (0.30) | — | |
| SCHEMBL11667180 | 0.70 | — | — | |
| SCHEMBL6668183 | 0.70 | — | — | |
| SCHEMBL15154897 | 0.68 | — | — | |
| SCHEMBL11664011 | 0.67 | — | — | |
| SCHEMBL27396848 | 0.67 | — | — | |
| SCHEMBL28606632 | 0.66 | — | — | |
| SCHEMBL11251990 | 0.66 | — | — |
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-0257967-B1 | PROCESS FOR MAKING 1,3-GLYCOLS FROM EPOXIDES | HOECHST CELANESE CORPORATION (US) | 1993-05-19 | — | — | EP | disclosed |
| EP-0469829-A2 | Process for making 1,3-diols from epoxides | HOECHST CELANESE CORPORATION (US) | 1992-02-05 | — | — | EP | disclosed |
| US-5053562-A | Process for making 1,3-diols from epoxides | HOECHST CELANESE CORPORATION (US) | 1991-10-01 | — | — | US | disclosed |
| US-4935554-A | Process for making 1,3-diols from epoxides | HOECHST CELANESE CORPORATION (US) | 1990-06-19 | — | — | US | disclosed |
| EP-0343944-A2 | Process for making 1,3-diols from epoxides | HOECHST CELANESE CORPORATION (US) | 1989-11-29 | — | — | EP | disclosed |
| US-4873379-A | REACTING AN EPOXIDE WITH SYNTHESIS GAS IN THE PRESENCE OF A RHODIUM CATALYST AND AN ALKALI METAL COMPOUND | HOECHST CELANESE CORPORATION (US) | 1989-10-10 | — | — | US | disclosed |
| US-4873378-A | Process for making 1,3-diols from epoxides | HOECHST CELANESE CORPORATION (US) | 1989-10-10 | — | — | US | disclosed |
| EP-0257967-A2 | Process for making 1,3-glycols from epoxides | HOECHST CELANESE CORPORATION (US) | 1988-03-02 | — | — | EP | disclosed |
| US-4342681-A | Use of organic silicon compounds in combination with oxetane compounds, dioxanes or tetrahydrofuranes for stabilizing and brightening polycarbonates which are free from phosphites and free from boric acid esters | BAYER AKTIENGESELLSCHAFT (DE) | 1982-08-03 | — | — | US | disclosed |
| EP-0019217-A1 | Use of organic silicium compounds in combination with oxetane compounds, dioxanes or tetrahydrofuranes for the stabilisation and brightening of polycarbonates free from phosphites and boric acid esters | BAYER AG (DE) | 1980-11-26 | — | — | EP | disclosed |