⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL534897 | 1.00 | — | — | |
| SCHEMBL5937315 | 0.82 | — | — | |
| SCHEMBL188 | 0.71 | — | — | |
| SCHEMBL9177548 | 0.71 | — | — | |
| SCHEMBL17931018 | 0.71 | — | — | |
| SCHEMBL2514955 | 0.71 | — | — | |
| SCHEMBL176061 | 0.71 | — | — | |
| SCHEMBL17931017 | 0.71 | — | — | |
| SCHEMBL822 | 0.71 | — | — | |
| SCHEMBL8027945 | 0.71 | — | — |
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-116332909-A | Aromatic vinyl compound, metal complex thereof, preparation method and application thereof | 上海再极医药科技有限公司 | 2023-06-27 | — | — | CN | disclosed |
| CN-114713284-A | Organic conjugated polymer photocatalyst containing B ← N coordination bond, preparation method and application | 兰州大学 | 2022-07-08 | — | — | CN | disclosed |