⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2185695 | 1.00 | — | — | |
| SCHEMBL28193871 | 0.94 | — | — | |
| Water SCHEMBL916080 | 0.94 | — | — | |
| SCHEMBL22287286 | 0.94 | — | — | |
| SCHEMBL545045 | 0.93 | — | — | |
| SCHEMBL914235 | 0.93 | — | — | |
| SCHEMBL27496571 | 0.93 | — | — | |
| SCHEMBL28911677 | 0.93 | — | — | |
| SCHEMBL28644687 | 0.93 | — | — | |
| SCHEMBL2185196 | 0.93 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-111432779-A | Cosmetic composition for immediate wrinkle improvement and elasticity enhancement | 株式会社LG生活健康 | 2020-07-17 | — | — | CN | disclosed |