⚠ 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 | |
|---|---|---|---|---|
| Iodide SCHEMBL15550173 | 0.97 | — | — | |
| SCHEMBL13090189 | 0.96 | — | — | |
| SCHEMBL469151 | 0.96 | — | — | |
| SCHEMBL12557935 | 0.96 | — | — | |
| Hydrochloric Acid SCHEMBL22575507 | 0.93 | — | — | |
| Water SCHEMBL28162043 | 0.93 | — | — | |
| Hydrochloric Acid SCHEMBL28036675 | 0.90 | — | — | |
| SCHEMBL6552267 | 0.82 | CHRNB2 (0.31) | — | |
| SCHEMBL20768162 | 0.82 | GRIN1 (0.32) | — | |
| SCHEMBL1678603 | 0.81 | TSHR (0.35) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1782127-B1 | LITHOGRAPHIC PRINTING PLATE PRECURSOR | EASTMAN KODAK CO (US) | 2008-04-02 | — | — | EP | disclosed |
| EP-1782127-A1 | LITHOGRAPHIC PRINTING PLATE PRECURSOR | EASTMAN KODAK COMPANY (US) | 2007-05-09 | — | — | EP | disclosed |
| WO-2006023667-A1 | LITHOGRAPHIC PRINTING PLATE PRECURSOR | EASTMAN KODAK COMPANY (US) | 2006-03-02 | — | — | WO | disclosed |