⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6054 | 0.80 | — | — | |
| Alcohol SCHEMBL28179609 | 0.77 | — | — | |
| SCHEMBL28254158 | 0.76 | — | — | |
| Acetone SCHEMBL29031107 | 0.76 | — | — | |
| Water SCHEMBL8843793 | 0.76 | — | — | |
| Water SCHEMBL1849552 | 0.76 | — | — | |
| SCHEMBL28268866 | 0.76 | — | — | |
| Formic Acid SCHEMBL30567257 | 0.76 | — | — | |
| Acetone SCHEMBL27258686 | 0.72 | — | — | |
| Acetone SCHEMBL28304157 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1784391-A1 | PHENANTHRIDINE CARBONYL PHENOLS AS CYTOKINE EXPRESSION MODULATORS | Wyeth (US) | 2007-05-16 | — | — | EP | disclosed |
| WO-2006028875-A1 | PHENANTHRIDINE CARBONYL PHENOLS AS CYTOKINE MODULATORS | WYETH (US) | 2006-03-16 | — | — | WO | disclosed |