⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7090818 | 0.91 | — | — | |
| SCHEMBL7091751 | 0.83 | — | — | |
| SCHEMBL7093563 | 0.79 | — | — | |
| SCHEMBL7089300 | 0.76 | — | — | |
| SCHEMBL7088578 | 0.75 | — | — | |
| SCHEMBL7090960 | 0.74 | — | — | |
| SCHEMBL7091699 | 0.73 | — | — | |
| SCHEMBL7093080 | 0.71 | — | — | |
| SCHEMBL7092501 | 0.71 | — | — | |
| SCHEMBL5608274 | 0.69 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6653486-B2 | Photopolymerizable; vinyl ether, photoinitiator, iodinium salt, and visible light sensitizer; dentistry, adhesives | CURATORS OF THE UNIVERSITY OF MISSOURI | 2003-11-25 | — | — | US | disclosed |
| US-20030119931-A1 | Novel spiroorthocarbonates | THE CURATORS OF THE UNIVERSITY OF MISSOURI | 2003-06-26 | — | — | US | disclosed |