⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6053813 | 0.89 | — | — | |
| SCHEMBL6053626 | 0.83 | — | — | |
| SCHEMBL6053823 | 0.71 | — | — | |
| SCHEMBL6053937 | 0.67 | — | — | |
| SCHEMBL6053809 | 0.65 | — | — | |
| SCHEMBL6053612 | 0.60 | — | — | |
| SCHEMBL4577181 | 0.59 | — | — | |
| SCHEMBL6284777 | 0.59 | KDM4E (0.30) | — | |
| SCHEMBL6053631 | 0.58 | NPC1 (0.30) | — | |
| SCHEMBL6343846 | 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 |
|---|---|---|---|---|---|---|---|
| EP-1629018-A1 | CLASS OF METALLOCENES AND METHOD OF PRODUCING POLYETHYLENE | Univation Technologies LLC (US) | 2006-03-01 | — | — | EP | disclosed |
| US-6911508-B2 | Class of metallocenes and method of producing polyethylene | UNIVATION TECHNOLOGIES, LLC (US) | 2005-06-28 | — | — | US | disclosed |
| WO-2004108771-A1 | CLASS OF METALLOCENES AND METHOD OF PRODUCING POLYETHYLENE | UNIVATION TECHNOLOGIES, LLC (US) | 2004-12-16 | — | — | WO | disclosed |
| US-20040249096-A1 | Class of metallocenes and method of producing polyethylene | EXXONMOBIL CHEMICAL PATENTS INC. | 2004-12-09 | — | — | US | disclosed |