⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL33734 | 0.79 | USP2 (0.34) | — | |
| SCHEMBL2535793 | 0.60 | ADORA1 (0.35) | — | |
| SCHEMBL2271763 | 0.60 | — | — | |
| SCHEMBL2269294 | 0.60 | — | — | |
| SCHEMBL2267817 | 0.58 | SMN1; SMN2 (0.51) | — | |
| SCHEMBL2270595 | 0.57 | MAPT (0.42) | — | |
| SCHEMBL19547313 | 0.57 | — | — | |
| SCHEMBL2265124 | 0.57 | HRH1 (0.33) | — | |
| SCHEMBL14373986 | 0.54 | USP2 (0.64) | — | |
| SCHEMBL33733 | 0.51 | KDM4E (0.40) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6733539-B2 | HAIR DYES | L'OREAL S.A. (FR) | 2004-05-11 | — | — | US | claimed |
| US-20020170122-A9 | Compositions for the oxidation dyeing of keratinous fibers comprising at least one oxidation dye and at least one enzymatic oxidizing agent, and dyeing methods | L'OREAL S.A. (FR) | 2002-11-21 | — | — | US | claimed |
| US-20020013973-A1 | Compositions for the oxidation dyeing of keratinous fibers comprising at least one oxidation dye and at least one enzymatic oxidizing agent, and dyeing methods | PLOS GREGORY (FR) | 2002-02-07 | — | — | US | claimed |