⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13123280 | 0.78 | — | — | |
| SCHEMBL1244626 | 0.77 | ALDH1A1 (0.32) | — | |
| SCHEMBL1012248 | 0.76 | — | — | |
| SCHEMBL3680497 | 0.76 | — | — | |
| SCHEMBL1013181 | 0.76 | — | — | |
| SCHEMBL106707 | 0.76 | — | — | |
| SCHEMBL6240119 | 0.75 | ALDH1A1 (0.36) | — | |
| SCHEMBL6236759 | 0.75 | ALDH1A1 (0.36) | — | |
| SCHEMBL7537403 | 0.73 | — | — | |
| SCHEMBL12319666 | 0.73 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1983023-A1 | Radiation-curable composition, composite and manufacturing method thereof | JSR Corporation (JP) | 2008-10-22 | — | — | EP | disclosed |