⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5894758 | 0.88 | — | — | |
| SCHEMBL5894602 | 0.84 | LMNA (0.36) | — | |
| SCHEMBL5894297 | 0.81 | MEN1 (0.34) | — | |
| SCHEMBL5894802 | 0.79 | MAPT (0.41) | — | |
| SCHEMBL5894414 | 0.76 | HSP90AA1 (0.50) | — | |
| SCHEMBL5894639 | 0.75 | IDO1 (0.38) | — | |
| SCHEMBL5894364 | 0.73 | KEAP1 (0.36) | — | |
| SCHEMBL5894601 | 0.73 | KEAP1 (0.36) | — | |
| SCHEMBL5894026 | 0.71 | PRKCI (0.30) | — | |
| SCHEMBL5894457 | 0.70 | PRKCI (0.33) | — |
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-20060156485-A1 | Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof | THE PROCTER & GAMBLE COMPANY (US) | 2006-07-20 | — | — | US | claimed |
| US-20060156485-A1 | Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof | THE PROCTER & GAMBLE COMPANY (US) | 2006-07-20 | — | — | US | disclosed |