⚠ 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 | |
|---|---|---|---|---|
| Perchlorate SCHEMBL29664202 | 0.91 | — | — | |
| Perchlorate SCHEMBL852780 | 0.91 | — | — | |
| Perchlorate SCHEMBL7175531 | 0.83 | — | — | |
| Perchlorate SCHEMBL4808588 | 0.83 | — | — | |
| Perchlorate SCHEMBL103749 | 0.83 | — | — | |
| Perchlorate SCHEMBL8843585 | 0.77 | — | — | |
| Perchlorate SCHEMBL108521 | 0.77 | — | — | |
| Perchlorate SCHEMBL108523 | 0.77 | — | — | |
| Perchlorate SCHEMBL5022933 | 0.73 | — | — | |
| Perchlorate SCHEMBL5942200 | 0.73 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4661609-A | TRANSESTERIFICATION OF METHANOL AND ETHYLENE CARBONATE WITH ZIRCONIUM, TITANIUM OR TIN CONTAINING CATALYST | TEXACO INC. (US) | 1987-04-28 | — | — | US | claimed |
| EP-0255252-B1 | PROCESS FOR COSYNTHESIS OF ETHYLENE GLYCOL AND DIMETHYL CARBONATE | TEXACO DEVELOPMENT CORPORATION (US) | 1992-09-16 | — | — | EP | disclosed |
| EP-0255252-A2 | Process for cosynthesis of ethylene glycol and dimethyl carbonate | TEXACO DEVELOPMENT CORPORATION (US) | 1988-02-03 | — | — | EP | disclosed |
| US-4661609-A | TRANSESTERIFICATION OF METHANOL AND ETHYLENE CARBONATE WITH ZIRCONIUM, TITANIUM OR TIN CONTAINING CATALYST | TEXACO INC. (US) | 1987-04-28 | — | — | US | disclosed |