⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2197271 | 0.93 | — | — | |
| SCHEMBL28753323 | 0.93 | — | — | |
| SCHEMBL27690092 | 0.84 | — | — | |
| SCHEMBL5406652 | 0.84 | — | — | |
| SCHEMBL2383715 | 0.84 | — | — | |
| SCHEMBL4575881 | 0.84 | — | — | |
| SCHEMBL5586427 | 0.84 | — | — | |
| Water SCHEMBL5029033 | 0.77 | — | — | |
| SCHEMBL28467523 | 0.77 | — | — | |
| SCHEMBL17289525 | 0.77 | — | — |
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-113754386-B | Anti-ultraviolet radiation concrete and preparation method thereof | 云南中建西部建设有限公司 | 2022-06-03 | — | — | CN | disclosed |
| CN-113754386-A | Anti-ultraviolet radiation concrete and preparation method thereof | 云南中建西部建设有限公司 | 2021-12-07 | — | — | CN | disclosed |