⚠ 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 | |
|---|---|---|---|---|
| Acrylic Acid SCHEMBL30557948 | 0.85 | LMNA (0.67) | — | |
| Acrylic Acid SCHEMBL1399461 | 0.85 | — | — | |
| Acrylamide SCHEMBL28520978 | 0.83 | ALDH1A1 (0.61) | — | |
| Acrylamide SCHEMBL2369357 | 0.83 | — | — | |
| Acrylic Acid SCHEMBL5597380 | 0.82 | LMNA (0.62) | — | |
| Acrylic Acid SCHEMBL1085535 | 0.82 | LMNA (0.62) | — | |
| Acrylic Acid SCHEMBL27828971 | 0.82 | LMNA (0.71) | — | |
| Acrylic Acid SCHEMBL4627566 | 0.80 | — | — | |
| Acrylic Acid SCHEMBL1399480 | 0.80 | LMNA (0.59) | — | |
| Fumaric Acid SCHEMBL3064687 | 0.80 | TSHR (0.53) | — |
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-105658633-A | Polymer-flavonoid conjugates and hydrogels for biomedical applications | 新加坡科技研究局 | 2016-06-08 | — | — | CN | disclosed |