⚠ 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 | |
|---|---|---|---|---|
| Water SCHEMBL21680903 | 0.87 | — | — | |
| SCHEMBL28090957 | 0.87 | — | — | |
| SCHEMBL795669 | 0.82 | — | — | |
| SCHEMBL41820 | 0.82 | — | — | |
| SCHEMBL62875 | 0.82 | — | — | |
| SCHEMBL28635781 | 0.82 | — | — | |
| SCHEMBL28836892 | 0.82 | — | — | |
| SCHEMBL11119384 | 0.82 | — | — | |
| SCHEMBL4830833 | 0.82 | — | — | |
| SCHEMBL8324965 | 0.82 | — | — |
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-105518179-B | Reactive sputtering apparatus | 株式会社爱发科 | 2018-06-22 | — | — | CN | disclosed |