⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29442074 | 0.89 | — | — | |
| SCHEMBL352101 | 0.89 | — | — | |
| SCHEMBL116944 | 0.86 | — | — | |
| SCHEMBL30973629 | 0.85 | — | — | |
| SCHEMBL218930 | 0.82 | — | — | |
| SCHEMBL5375327 | 0.81 | ACHE (0.33) | — | |
| SCHEMBL29907880 | 0.80 | — | — | |
| SCHEMBL29497620 | 0.80 | — | — | |
| SCHEMBL394834 | 0.80 | — | — | |
| SCHEMBL3117464 | 0.79 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0813447-B1 | BRIDGED BIS-AMIDO GROUP 4 METAL COMPOUNDS IN A CATALYST COMPOSITION | SHELL INT RESEARCH (NL) | 1998-10-21 | — | — | EP | claimed |
| US-20020035219-A1 | Catalyst system for alpha-olefin oligomerization | HORTON ANDREW D (NL) | 2002-03-21 | — | — | US | disclosed |
| US-6335303-B1 | EFFECTIVE IN POLYMERIZATION OF ALPHA OLEFINS TO HIGH MOLECULAR WEIGHT POLYMERS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA | 2002-01-01 | — | — | US | disclosed |
| WO-1998045039-A1 | POLYMERIZATION CATALYSTS CONTAINING ELECTRON-WITHDRAWING AMIDE LIGANDS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1998-10-15 | — | — | WO | disclosed |
| US-5726115-A | OLIGOMERIZATION OF OLEFINS | SHELL OIL COMPANY (US) | 1998-03-10 | — | — | US | disclosed |