⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30457686 | 0.72 | — | — | |
| SCHEMBL6323925 | 0.69 | — | — | |
| SCHEMBL28238679 | 0.62 | — | — | |
| Dimethylformamide SCHEMBL27935018 | 0.61 | TSHR (0.30) | — | |
| SCHEMBL6278044 | 0.60 | — | — | |
| Bicarbonate SCHEMBL7645241 | 0.60 | — | — | |
| SCHEMBL19750859 | 0.59 | TSHR (0.35) | — | |
| SCHEMBL27865324 | 0.59 | — | — | |
| SCHEMBL4258155 | 0.59 | — | — | |
| Acrylic Acid SCHEMBL29733284 | 0.59 | LMNA (0.39) | — |
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-108008600-B | Radiation-sensitive composition | 三菱瓦斯化学株式会社 | 2021-02-09 | — | — | CN | disclosed |