⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5839733 | 0.82 | — | — | |
| SCHEMBL29107152 | 0.82 | — | — | |
| SCHEMBL285257 | 0.82 | — | — | |
| SCHEMBL11129484 | 0.82 | — | — | |
| SCHEMBL8081911 | 0.82 | — | — | |
| SCHEMBL59559 | 0.82 | — | — | |
| SCHEMBL2240481 | 0.82 | — | — | |
| SCHEMBL11287667 | 0.67 | — | — | |
| SCHEMBL5440409 | 0.67 | — | — | |
| SCHEMBL9095436 | 0.67 | — | — |
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-107074726-B | Synthesis of novel anti-inflammatory compounds | 广州丹康医药生物有限公司 | 2020-01-24 | — | — | CN | disclosed |