⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6910379 | 0.58 | — | — | |
| SCHEMBL5616516 | 0.57 | — | — | |
| SCHEMBL17581074 | 0.53 | — | — | |
| SCHEMBL22519294 | 0.51 | PTPN1 (0.34) | — | |
| SCHEMBL15914680 | 0.50 | — | — | |
| SCHEMBL16918920 | 0.50 | — | — | |
| SCHEMBL6693498 | 0.49 | — | — | |
| SCHEMBL2419716 | 0.48 | — | — | |
| SCHEMBL5074259 | 0.48 | — | — | |
| SCHEMBL8758 | 0.48 | — | — |
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-7629464-B2 | polymerization catalyst for the polymerization of olefins; molecular weight control of polyethylene, ethylene-hexene copolymer; addition polymerization; 1-(diisopropyl(2-oxypyridine)silyl)-3-methylcyclopentadienyl)chromium dichloride | BASELL POLYOLEFINE GMBH (DE) | 2009-12-08 | — | — | US | disclosed |
| US-20070213483-A1 | Monocyclopentadienyl Complexes | BASELL POLYOLEFINE GMBH (DE) | 2007-09-13 | — | — | US | disclosed |
| EP-1694719-A2 | MONOCYCLOPENTADIENYL COMPLEXES | Basell Polyolefine GmbH (DE) | 2006-08-30 | — | — | EP | disclosed |
| WO-2005058983-A2 | MONOCYCLOPENTADIENYL COMPLEXES | BASELL POLYOLEFINE GMBH (DE) | 2005-06-30 | — | — | WO | disclosed |