⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4480097 | 0.97 | — | — | |
| SCHEMBL820172 | 0.97 | — | — | |
| Fluoride SCHEMBL863576 | 0.94 | — | — | |
| SCHEMBL9579650 | 0.94 | — | — | |
| Hydrogen Sulfide SCHEMBL220005 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL221973 | 0.94 | — | — | |
| Bromide SCHEMBL8712158 | 0.94 | — | — | |
| Methane SCHEMBL9168791 | 0.94 | — | — | |
| SCHEMBL8559679 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL597368 | 0.94 | — | — |
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-0412750-B1 | Production of alpha-olefin polymers | MITSUBISHI PETROCHEMICAL CO (JP) | 1995-02-15 | — | — | EP | disclosed |
| US-5104838-A | Titanium-containing solid catalyst component | MITSUBISHI PETROCHEMICAL COMPANY LIMITED (JP) | 1992-04-14 | — | — | US | disclosed |
| EP-0412750-A2 | Production of alpha-olefin polymers | MITSUBISHI CHEMICAL CORPORATION (JP) | 1991-02-13 | — | — | EP | disclosed |