⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7529487 | 0.97 | — | — | |
| SCHEMBL7520410 | 0.83 | — | — | |
| SCHEMBL7526318 | 0.83 | — | — | |
| SCHEMBL7452262 | 0.81 | — | — | |
| SCHEMBL7462362 | 0.81 | — | — | |
| SCHEMBL7455294 | 0.80 | — | — | |
| SCHEMBL7458502 | 0.76 | — | — | |
| SCHEMBL7528542 | 0.75 | — | — | |
| SCHEMBL7042921 | 0.75 | — | — | |
| SCHEMBL6290904 | 0.74 | HSP90AA1 (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 |
|---|---|---|---|---|---|---|---|
| EP-1181005-A1 | OXIDATION DYEING COMPOSITION FOR KERATINOUS FIBRES AND DYEING METHOD USING SAME | L'OREAL (FR) | 2002-02-27 | — | — | EP | disclosed |
| WO-2001066071-A1 | OXIDATION DYEING COMPOSITION FOR KERATINOUS FIBRES AND DYEING METHOD USING SAME | L'OREAL (FR) | 2001-09-13 | — | — | WO | disclosed |