⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2269071 | 0.59 | — | — | |
| Hydrochloric Acid SCHEMBL6288031 | 0.58 | — | — | |
| SCHEMBL11652181 | 0.51 | HPGD (0.50) | — | |
| SCHEMBL14412553 | 0.50 | — | — | |
| SCHEMBL17045561 | 0.49 | SMN1; SMN2 (0.39) | — | |
| SCHEMBL34038 | 0.49 | IKBKB (0.31) | — | |
| SCHEMBL34154 | 0.48 | — | — | |
| SCHEMBL22731601 | 0.48 | — | — | |
| SCHEMBL1559796 | 0.48 | — | — | |
| SCHEMBL6911336 | 0.47 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20020004959-A1 | Oxidizing composition and uses for dyeing, for permanently reshaping or for bleaching keratin fibres | L'OREAL S.A. | 2002-01-17 | — | — | US | disclosed |