⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5445409 | 0.74 | — | — | |
| Lithium SCHEMBL31187741 | 0.70 | — | — | |
| SCHEMBL2746209 | 0.70 | — | — | |
| SCHEMBL5054729 | 0.67 | ALDH1A1 (0.30) | — | |
| SCHEMBL928602 | 0.67 | — | — | |
| SCHEMBL2110089 | 0.67 | — | — | |
| Carbon Tetrachloride SCHEMBL29059085 | 0.65 | — | — | |
| SCHEMBL5054730 | 0.65 | — | — | |
| SCHEMBL11140270 | 0.64 | — | — | |
| SCHEMBL10668689 | 0.61 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1874462-A2 | IMPROVED POLYMER HALOGENATION PROCESS WITH CATALYST RECOVERY | ALBEMARLE CORPORATION (US) | 2008-01-09 | — | — | EP | claimed |
| WO-2006105115-A2 | IMPROVED POLYMER HALOGENATION PROCESS WITH CATALYST RECOVERY | ALBEMARLE CORPORATION (US) | 2006-10-05 | — | — | WO | claimed |