⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL700675 | 0.97 | — | — | |
| SCHEMBL655223 | 0.94 | — | — | |
| SCHEMBL7641327 | 0.94 | — | — | |
| SCHEMBL28306350 | 0.94 | — | — | |
| SCHEMBL4007239 | 0.94 | — | — | |
| Lithium SCHEMBL31020369 | 0.94 | — | — | |
| SCHEMBL16566844 | 0.94 | — | — | |
| Potassium SCHEMBL31124787 | 0.94 | — | — | |
| SCHEMBL508198 | 0.94 | — | — | |
| Acetic Acid SCHEMBL288008 | 0.91 | FFAR3 (0.41) | — |
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-108484617-B | Novel benzofuran azanaphthalene dione derivative and preparation method thereof | 爱斯特（成都）生物制药股份有限公司 | 2021-08-31 | — | — | CN | disclosed |