⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1584887 | 0.89 | — | — | |
| SCHEMBL15284915 | 0.89 | — | — | |
| SCHEMBL385594 | 0.89 | — | — | |
| SCHEMBL28244084 | 0.89 | — | — | |
| SCHEMBL9452107 | 0.89 | — | — | |
| SCHEMBL23036815 | 0.80 | — | — | |
| SCHEMBL31458536 | 0.80 | — | — | |
| SCHEMBL31073530 | 0.80 | — | — | |
| SCHEMBL19097706 | 0.80 | — | — | |
| SCHEMBL4606195 | 0.80 | — | — |
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-112626443-A | Wear-resistant anticorrosive coating and preparation method thereof | 中机凯博表面技术江苏有限公司 | 2021-04-09 | — | — | CN | disclosed |