⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL62839 | 1.00 | — | — | |
| SCHEMBL8979292 | 1.00 | — | — | |
| SCHEMBL4452832 | 1.00 | — | — | |
| SCHEMBL4457415 | 0.80 | — | — | |
| SCHEMBL8572177 | 0.76 | — | — | |
| SCHEMBL6362414 | 0.76 | — | — | |
| SCHEMBL5705394 | 0.72 | — | — | |
| SCHEMBL3110584 | 0.68 | — | — | |
| SCHEMBL9843325 | 0.68 | — | — | |
| SCHEMBL3682598 | 0.68 | — | — |
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-20090131705-A1 | Practical, Cost-Effective Synthesis of Ubiquinones | ZYMES, LLC | 2009-05-21 | — | — | US | disclosed |
| US-20080086013-A1 | CARBOMETALLATION OF ALKYNES AND IMPROVED SYNTHESIS OF UNIQUINONES | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2008-04-10 | — | — | US | disclosed |
| WO-2008019196-A2 | CARBOMETALLATION OF ALKYNES AND IMPROVED SYNTHSIS OF UBIQUINONES | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2008-02-14 | — | — | WO | disclosed |
| US-20060167289-A1 | Practical, cost-effective synthesis of ubiquinones | ZYMES, LLC (US) | 2006-07-27 | — | — | US | disclosed |