⚠ 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL7657061 | 1.00 | — | — | |
| Ammonia Solution, Strong SCHEMBL28107162 | 0.87 | — | — | |
| Ammonia Solution, Strong SCHEMBL8427801 | 0.82 | — | — | |
| Hydrogen Sulfide SCHEMBL11239718 | 0.82 | GSK3B (0.50) | — | |
| Ammonia Solution, Strong SCHEMBL268826 | 0.82 | — | — | |
| Hydrogen Sulfide SCHEMBL1333964 | 0.82 | — | — | |
| Ammonia Solution, Strong SCHEMBL3763915 | 0.82 | — | — | |
| Ammonia Solution, Strong SCHEMBL692403 | 0.82 | — | — | |
| Ammonia Solution, Strong SCHEMBL3817872 | 0.82 | — | — | |
| Ammonia Solution, Strong SCHEMBL4179168 | 0.82 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11446525-B2 | Methods for fixing hair and skin | OLAPLEX, INC. (US) | 2022-09-20 | — | — | US | disclosed |
| CN-106957055-B | A kind of sulphur, nitrogen, transient metal doped graphene and the preparation method and application thereof | 华南师范大学 | 2019-01-18 | — | — | CN | disclosed |
| CN-106957055-A | A kind of sulphur, nitrogen, transient metal doped graphene and preparation method and application | 华南师范大学 | 2017-07-18 | — | — | CN | disclosed |
| CN-1109873-A | Thioimidates, their preparation and their use | BASF AKTEINGESELLSCHAFT (DE) | 1995-10-11 | — | — | CN | disclosed |