⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8464388 | 1.00 | — | — | |
| SCHEMBL27531759 | 0.95 | — | — | |
| SCHEMBL27569318 | 0.89 | — | — | |
| SCHEMBL6714351 | 0.82 | — | — | |
| SCHEMBL9059131 | 0.80 | — | — | |
| SCHEMBL9059132 | 0.80 | — | — | |
| SCHEMBL8464003 | 0.66 | — | — | |
| SCHEMBL2379668 | 0.65 | — | — | |
| SCHEMBL2379667 | 0.65 | — | — | |
| Hydrochloric Acid SCHEMBL6317557 | 0.63 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5990033-A | GROUP 4 METAL COMPLEXES IN THE +2 OR +3 FORMAL OXIDATION STATE AND CONTAINING AN ANIONIC PENTADIENYL LIGAND OR A SUBSTITUTED DERIVATIVE THEREOF AND ACTIVATING COCATALYSTS ARE USED AS ADDITION POLYMERIZATION CATALYSTS | THE DOW CHEMICAL COMPANY (US) | 1999-11-23 | — | — | US | disclosed |