⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8901532 | 0.99 | — | — | |
| SCHEMBL8854331 | 0.98 | — | — | |
| SCHEMBL30289966 | 0.69 | — | — | |
| SCHEMBL30844630 | 0.68 | — | — | |
| SCHEMBL29000091 | 0.64 | — | — | |
| Hydrochloric Acid SCHEMBL28911379 | 0.63 | — | — | |
| Hydrochloric Acid SCHEMBL6252062 | 0.63 | — | — | |
| SCHEMBL6249663 | 0.63 | — | — | |
| SCHEMBL8160103 | 0.62 | — | — | |
| Hydrochloric Acid SCHEMBL22492220 | 0.62 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0705269-B1 | TITANIUM(II) OR ZIRCONIUM(II) COMPLEXES AND ADDITION POLYMERIZATION CATALYSTS THEREFROM | DOW CHEMICAL CO (US) | 1997-01-15 | — | — | EP | disclosed |
| US-5556928-A | COORDINATION CATALYSTS FOR ADDITION POLYMERIZATION | THE DOW CHEMICAL COMPANY (US) | 1996-09-17 | — | — | US | disclosed |
| EP-0705269-A1 | TITANIUM(II) OR ZIRCONIUM(II) COMPLEXES AND ADDITION POLYMERIZATION CATALYSTS THEREFROM | DOW CHEMICAL CO (US) | 1996-04-10 | — | — | EP | disclosed |
| WO-1995000526-A1 | TITANIUM(II) OR ZIRCONIUM(II) COMPLEXES AND ADDITION POLYMERIZATION CATALYSTS THEREFROM | THE DOW CHEMICAL COMPANY (US) | 1995-01-05 | — | — | WO | disclosed |