⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5252500 | 0.80 | — | — | |
| SCHEMBL9098882 | 0.79 | — | — | |
| SCHEMBL8700694 | 0.78 | — | — | |
| SCHEMBL4630012 | 0.65 | — | — | |
| SCHEMBL4641826 | 0.65 | — | — | |
| SCHEMBL291625 | 0.65 | — | — | |
| SCHEMBL2402958 | 0.64 | — | — | |
| Bromide SCHEMBL11114085 | 0.62 | — | — | |
| SCHEMBL16828929 | 0.61 | — | — | |
| SCHEMBL1685040 | 0.61 | — | — |
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-20110117220-A1 | PREPARATION METHOD OF PLANT EXTRACT USING HIGH PRESSURE-ENZYMATIC DECOMPOSITION TECHNIQUE AND THE COSMETIC COMPOSITION CONTAINING THE EXTRACT | AMOREPACIFIC CORPORATION (KR) | 2011-05-19 | — | — | US | disclosed |