⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28096584 | 0.89 | — | — | |
| SCHEMBL14801367 | 0.89 | — | — | |
| SCHEMBL27853293 | 0.82 | — | — | |
| SCHEMBL27632902 | 0.82 | — | — | |
| SCHEMBL7139777 | 0.76 | — | — | |
| SCHEMBL3207719 | 0.68 | — | — | |
| Trimethylammonium SCHEMBL27861441 | 0.63 | — | — | |
| Ethylene SCHEMBL27990383 | 0.59 | — | — | |
| Trimethylammonium SCHEMBL27345537 | 0.56 | — | — | |
| SCHEMBL31598502 | 0.33 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-10982112-B2 | Hydrophobic silicone coating | CHEMICAL DYNAMICS LLC (US) | 2021-04-20 | — | — | US | claimed |