⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5172187 | 0.89 | KDM4E (0.30) | — | |
| SCHEMBL5035871 | 0.73 | ATAD2 (0.38) | — | |
| SCHEMBL5491094 | 0.69 | ATAD2 (0.32) | — | |
| SCHEMBL5174738 | 0.69 | — | — | |
| SCHEMBL5172377 | 0.69 | — | — | |
| SCHEMBL5171847 | 0.69 | HRH4 (0.33) | — | |
| SCHEMBL5487319 | 0.69 | ATAD2 (0.34) | — | |
| SCHEMBL5184175 | 0.69 | ATAD2 (0.34) | — | |
| SCHEMBL5171871 | 0.67 | KDM4E (0.33) | — | |
| SCHEMBL5173051 | 0.66 | ATAD2 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7276089-B2 | Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof | THE PROCTER & GAMBLE COMPANY (US) | 2007-10-02 | — | — | US | disclosed |
| US-20060042025-A1 | Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof | NOXELL CORPORATION | 2006-03-02 | — | — | US | disclosed |