⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17581124 | 0.67 | — | — | |
| SCHEMBL10954159 | 0.65 | TP53 (0.32) | — | |
| SCHEMBL27619048 | 0.63 | — | — | |
| SCHEMBL337074 | 0.59 | — | — | |
| SCHEMBL17581061 | 0.59 | — | — | |
| SCHEMBL23803165 | 0.57 | — | — | |
| SCHEMBL27707609 | 0.57 | — | — | |
| SCHEMBL27707597 | 0.57 | — | — | |
| SCHEMBL31379010 | 0.57 | — | — | |
| SCHEMBL27688231 | 0.57 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1930193-B | Class of metallocenes and method of producing polyethylene | UNIVATION TECH LLC | 2011-03-23 | — | — | CN | disclosed |
| CN-1930193-A | Class of metallocenes and method of producing polyethylene | UNIVATION TECH LLC (US) | 2007-03-14 | — | — | CN | disclosed |
| US-6911508-B2 | Class of metallocenes and method of producing polyethylene | UNIVATION TECHNOLOGIES, LLC (US) | 2005-06-28 | — | — | US | disclosed |
| US-20040249096-A1 | Class of metallocenes and method of producing polyethylene | EXXONMOBIL CHEMICAL PATENTS INC. | 2004-12-09 | — | — | US | disclosed |