⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8158081 | 1.00 | — | — | |
| SCHEMBL5702799 | 0.79 | — | — | |
| SCHEMBL3682222 | 0.77 | — | — | |
| SCHEMBL3682226 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL9169562 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL9169556 | 0.75 | — | — | |
| SCHEMBL7538770 | 0.66 | — | — | |
| SCHEMBL2864571 | 0.66 | KDM1A (0.32) | — | |
| SCHEMBL27588117 | 0.66 | — | — | |
| SCHEMBL409648 | 0.65 | — | — |
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-6034021-A | COORDINATION CATALYST | THE DOW CHEMICAL COMPANY (US) | 2000-03-07 | — | — | US | disclosed |
| EP-0927187-A1 | METAL COMPLEXES CONTAINING BRIDGED, NON-AROMATIC, ANIONIC, DIENYL GROUPS AND ADDITION POLYMERIZATION CATALYSTS THEREFROM | THE DOW CHEMICAL COMPANY (US) | 1999-07-07 | — | — | EP | disclosed |
| US-5817849-A | Metal complexes containing bridged non-aromatic, anionic, dienyl groups and addition polymerization catalysts therefrom | THE DOW CHEMICAL COMPANY (US) | 1998-10-06 | — | — | US | disclosed |
| WO-1998003520-A1 | METAL COMPLEXES CONTAINING BRIDGED, NON-AROMATIC, ANIONIC, DIENYL GROUPS AND ADDITION POLYMERIZATION CATALYSTS THEREFROM | THE DOW CHEMICAL COMPANY (US) | 1998-01-29 | — | — | WO | disclosed |