⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28268718 | 0.89 | — | — | |
| SCHEMBL27738332 | 0.87 | LMNA (0.33) | — | |
| Vinyl Chloride SCHEMBL7055813 | 0.85 | — | — | |
| Methacrylic Acid SCHEMBL9067227 | 0.79 | TSHR (0.32) | — | |
| SCHEMBL8143858 | 0.78 | — | — | |
| SCHEMBL28229338 | 0.76 | ALOX15 (0.30) | — | |
| SCHEMBL9514036 | 0.72 | — | — | |
| SCHEMBL28212048 | 0.72 | TSHR (0.33) | — | |
| SCHEMBL28181035 | 0.69 | GRIK1 (0.32) | — | |
| SCHEMBL11266919 | 0.69 | ALDH1A1 (0.35) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106280618-A | A kind of preparation method of wood substrates coating | 陈雄 | 2017-01-04 | — | — | CN | claimed |
| CN-106280618-A | A kind of preparation method of wood substrates coating | 陈雄 | 2017-01-04 | — | — | CN | disclosed |