⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3411076 | 0.97 | — | — | |
| SCHEMBL55418 | 0.97 | — | — | |
| SCHEMBL28122431 | 0.94 | — | — | |
| SCHEMBL30413791 | 0.94 | — | — | |
| SCHEMBL55920 | 0.88 | — | — | |
| SCHEMBL5167023 | 0.88 | — | — | |
| SCHEMBL54883 | 0.85 | — | — | |
| SCHEMBL513133 | 0.85 | PTPN7 (0.48) | — | |
| SCHEMBL9015838 | 0.85 | PTPN7 (0.48) | — | |
| SCHEMBL1760681 | 0.85 | PTPN7 (0.48) | — |
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-112657021-B | Drug delivery device with laminated stopper | W.L.戈尔及同仁股份有限公司 | 2023-04-25 | — | — | CN | disclosed |