⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3626231 | 0.83 | — | — | |
| SCHEMBL130735 | 0.70 | — | — | |
| SCHEMBL690248 | 0.65 | — | — | |
| SCHEMBL3936851 | 0.64 | FGFR1 (0.33) | — | |
| SCHEMBL3626209 | 0.62 | — | — | |
| SCHEMBL626253 | 0.62 | — | — | |
| SCHEMBL209135 | 0.61 | — | — | |
| SCHEMBL16317 | 0.61 | KDM4A (0.32) | — | |
| SCHEMBL3934211 | 0.60 | ALDH1A1 (0.30) | — | |
| SCHEMBL292214 | 0.60 | SIGMAR1 (0.30) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7662193-B2 | Hair dye composition | KAO CORPORATION (JP) | 2010-02-16 | — | — | US | claimed |
| US-7662193-B2 | Hair dye composition | KAO CORPORATION (JP) | 2010-02-16 | — | — | US | disclosed |
| US-20090049622-A1 | HAIR DYE COMPOSITION | KAO CORPORATION (JP) | 2009-02-26 | — | — | US | disclosed |
| EP-1847249-A1 | HAIRDYE COMPOSITION | Kao Corporation (JP) | 2007-10-24 | — | — | EP | disclosed |