⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7752907 | 0.94 | — | — | |
| SCHEMBL6699147 | 0.94 | — | — | |
| SCHEMBL7752813 | 0.91 | TP53 (0.31) | — | |
| SCHEMBL2494925 | 0.88 | CDC25B (0.33) | — | |
| SCHEMBL6252507 | 0.88 | — | — | |
| SCHEMBL6463410 | 0.87 | CDC25B (0.36) | — | |
| SCHEMBL6698827 | 0.82 | TP53 (0.31) | — | |
| SCHEMBL1825864 | 0.80 | — | — | |
| SCHEMBL1832465 | 0.79 | — | — | |
| SCHEMBL13783711 | 0.78 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20110076466-A1 | TONER COMPOSITION FOR ELECTROSTATIC PHOTOGRAPHY, DEVELOPER FOR ELECTROSTATIC PHOTOGRAPHY, METHOD OF FORMING ELECTROSTATIC PHOTOGRAPHIC IMAGE, AND ELECTROSTATIC PHOTOGRAPHIC IMAGE | FUJIFILM CORPORATION (JP) | 2011-03-31 | — | — | US | disclosed |