⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL379653 | 0.69 | — | — | |
| SCHEMBL5664997 | 0.69 | — | — | |
| SCHEMBL1777205 | 0.65 | — | — | |
| SCHEMBL1494512 | 0.65 | — | — | |
| SCHEMBL5917335 | 0.65 | — | — | |
| SCHEMBL13557176 | 0.65 | — | — | |
| SCHEMBL2268305 | 0.63 | — | — | |
| SCHEMBL1727634 | 0.62 | — | — | |
| SCHEMBL1778513 | 0.62 | — | — | |
| SCHEMBL2274168 | 0.61 | TP53 (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1392706-A1 | OLEFIN POLYMERIZATION CATALYSTS CONTAINING A PYRROLE BISIMINE LIGAND | Univation Technologies LLC (US) | 2004-03-03 | — | — | EP | disclosed |
| WO-2002090366-A1 | OLEFIN POLYMERIZATION CATALYSTS CONTAINING A PYRROLE BISIMINE LIGAND | UNIVATION TECHNOLOGIES, LLC (US) | 2002-11-14 | — | — | WO | disclosed |
| EP-1021454-A1 | 2-HETEROATOM SUBSTITUTED CYCLOPENTADIENYL-CONTAINING METAL COMPLEXES AND OLEFIN POLYMERIZATION PROCESS | THE DOW CHEMICAL COMPANY (US) | 2000-07-26 | — | — | EP | disclosed |
| EP-0923589-A1 | 3-HETEROATOM SUBSTITUTED CYCLOPENTADIENYL-CONTAINING METAL COMPLEXES AND OLEFIN POLYMERIZATION PROCESS | THE DOW CHEMICAL COMPANY (US) | 1999-06-23 | — | — | EP | disclosed |
| WO-1998006727-A1 | 3-HETEROATOM SUBSTITUTED CYCLOPENTADIENYL-CONTAINING METAL COMPLEXES AND OLEFIN POLYMERIZATION PROCESS | THE DOW CHEMICAL COMPANY (US) | 1998-02-19 | — | — | WO | disclosed |
| WO-1998006728-A1 | 2-HETEROATOM SUBSTITUTED CYCLOPENTADIENYL-CONTAINING METAL COMPLEXES AND OLEFIN POLYMERIZATION PROCESS | THE DOW CHEMICAL COMPANY (US) | 1998-02-19 | — | — | WO | disclosed |