⚠ 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 | |
|---|---|---|---|---|
| Glycerin SCHEMBL29907853 | 0.91 | — | — | |
| Glycerin SCHEMBL6753203 | 0.91 | LMNA (1.00) | — | |
| Glycerin SCHEMBL10453101 | 0.91 | LMNA (1.00) | — | |
| Glycerin SCHEMBL14278795 | 0.91 | — | — | |
| Glycerin SCHEMBL5610362 | 0.91 | LMNA (1.00) | — | |
| Glycerin SCHEMBL9439059 | 0.91 | LMNA (1.00) | — | |
| Glycerin SCHEMBL8080917 | 0.91 | LMNA (1.00) | — | |
| Glycerin SCHEMBL14278797 | 0.91 | — | — | |
| Glycerin SCHEMBL797 | 0.91 | — | — | |
| Glycerin SCHEMBL3418854 | 0.91 | LMNA (1.00) | — |
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-104804167-A | Method for preparing polyurethane hydrogel responsive to both light and reducing agent | UNIV BEIJING CHEMICAL | 2015-07-29 | — | — | CN | disclosed |