⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6276562 | 0.71 | — | — | |
| SCHEMBL4629519 | 0.70 | — | — | |
| SCHEMBL4600169 | 0.70 | — | — | |
| SCHEMBL6461774 | 0.70 | — | — | |
| SCHEMBL6260418 | 0.69 | — | — | |
| SCHEMBL8167562 | 0.68 | — | — | |
| SCHEMBL4452535 | 0.68 | — | — | |
| SCHEMBL3677359 | 0.68 | NFKB1 (0.30) | — | |
| SCHEMBL5084764 | 0.66 | — | — | |
| SCHEMBL3619462 | 0.66 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5304614-A | Process for the preparation of an olefin polymer using metallocenes having specifically substituted indenyl ligands | HOECHST AKTIENGESELLSCHAFT (DE) | 1994-04-19 | — | — | US | claimed |
| EP-1115730-B1 | CATALYTIC PROCESS FOR ISOMERIZING METALLOCENES | ALBEMARLE CORP (US) | 2002-10-02 | — | — | EP | disclosed |
| EP-1115730-A1 | CATALYTIC PROCESS FOR ISOMERIZING METALLOCENES | ALBEMARLE CORPORATION (US) | 2001-07-18 | — | — | EP | disclosed |
| WO-2000017213-A1 | CATALYTIC PROCESS FOR ISOMERIZING METALLOCENES | ALBEMARLE CORPORATION (US) | 2000-03-30 | — | — | WO | disclosed |
| US-5965759-A | Catalytic process for isomerizing metallocenes | ALBEMARLE CORPORATION (US) | 1999-10-12 | — | — | US | disclosed |
| US-5304614-A | Process for the preparation of an olefin polymer using metallocenes having specifically substituted indenyl ligands | HOECHST AKTIENGESELLSCHAFT (DE) | 1994-04-19 | — | — | US | disclosed |