⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL838470 | 0.75 | — | — | |
| SCHEMBL18322822 | 0.71 | — | — | |
| SCHEMBL18878808 | 0.71 | ALDH1A1 (0.38) | — | |
| SCHEMBL901539 | 0.71 | — | — | |
| SCHEMBL6510774 | 0.70 | — | — | |
| SCHEMBL34977 | 0.68 | — | — | |
| SCHEMBL4022135 | 0.66 | — | — | |
| SCHEMBL28401642 | 0.65 | — | — | |
| SCHEMBL2859697 | 0.65 | — | — | |
| SCHEMBL31222832 | 0.65 | — | — |
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-115124974-A | Dealcoholized organosilicon sealant and preparation method thereof | 福建省昌德胶业科技有限公司 | 2022-09-30 | — | — | CN | disclosed |