⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6903158 | 0.84 | — | — | |
| SCHEMBL6903131 | 0.81 | NPC1 (0.30) | — | |
| SCHEMBL6899160 | 0.81 | NPC1 (0.30) | — | |
| SCHEMBL6905417 | 0.76 | NPC1 (0.31) | — | |
| Hydrochloric Acid SCHEMBL453592 | 0.74 | — | — | |
| SCHEMBL5080292 | 0.74 | LMNA (0.31) | — | |
| SCHEMBL6905960 | 0.72 | LMNA (0.32) | — | |
| SCHEMBL6902245 | 0.72 | NPC1 (0.32) | — | |
| SCHEMBL6897204 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL19056261 | 0.72 | LMNA (0.31) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1473323-B1 | Polyethylene composition and process for producing same | TOSOH CORP (JP) | 2016-04-27 | — | — | EP | disclosed |
| EP-1964860-A1 | ETHYLENE POLYMER, CATALYST FOR PRODUCTION OF ETHYLENE POLYMER, AND PROCESS FOR PRODUCTION OF ETHYLENE POLYMER | Tosoh Corporation (JP) | 2008-09-03 | — | — | EP | disclosed |
| EP-1473323-A1 | Polyethylene composition and process for producing same | Tosoh Corporation (JP) | 2004-11-03 | — | — | EP | disclosed |