⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9303179 | 0.85 | — | — | |
| SCHEMBL21919199 | 0.75 | — | — | |
| SCHEMBL21919198 | 0.75 | — | — | |
| SCHEMBL8720180 | 0.73 | — | — | |
| SCHEMBL21919200 | 0.73 | — | — | |
| SCHEMBL1219152 | 0.69 | — | — | |
| SCHEMBL11211865 | 0.69 | — | — | |
| Fluoride SCHEMBL28094744 | 0.69 | — | — | |
| SCHEMBL9569879 | 0.69 | — | — | |
| SCHEMBL1463059 | 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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0491872-B1 | POLYHALODIHYDRODIOXINS AND POLYHALODIOXOLES | DU PONT (US) | 1994-08-03 | — | — | EP | disclosed |
| US-5334731-A | Using halogenated dioxoles prepared by the catalytic dechlorination of halogenated dioxolanes | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1994-08-02 | — | — | US | disclosed |
| EP-0491872-A1 | POLYHALODIHYDRODIOXINS AND POLYHALODIOXOLES. | DU PONT (US) | 1992-07-01 | — | — | EP | disclosed |
| US-5026801-A | Polyhalodihydrodioxins and polyhalodioxoles | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1991-06-25 | — | — | US | disclosed |
| WO-1991004251-A2 | POLYHALODIHYDRODIOXINS AND POLYHALODIOXOLES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1991-04-04 | — | — | WO | disclosed |
| EP-0023293-B1 | PROCESS FOR PREPARING 2.3-PERFLUORO-1.4-DIOXANES AND TRIFLUORO METHYL-1,4-DIOXANES | HOECHST AKTIENGESELLSCHAFT (DE) | 1983-06-01 | — | — | EP | disclosed |
| US-4343742-A | CYCLIZATION OF MONOETHERS CONTAINING CARBONYL, AMMONIUM OR ALKALI FLUORIDE | HOECHST AKTIENGESELLSCHAFT | 1982-08-10 | — | — | US | disclosed |
| EP-0023293-A1 | Process for preparing 2.3-perfluoro-1.4-dioxanes and trifluoro methyl-1,4-dioxanes | HOECHST AKTIENGESELLSCHAFT (DE) | 1981-02-04 | — | — | EP | disclosed |