⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL776394 | 0.73 | ACHE (0.30) | — | |
| SCHEMBL15107892 | 0.71 | — | — | |
| SCHEMBL12986026 | 0.71 | — | — | |
| SCHEMBL6895940 | 0.71 | — | — | |
| SCHEMBL15494234 | 0.71 | — | — | |
| SCHEMBL12985626 | 0.71 | — | — | |
| SCHEMBL6895103 | 0.71 | — | — | |
| SCHEMBL13034547 | 0.71 | — | — | |
| SCHEMBL21214896 | 0.71 | — | — | |
| SCHEMBL15749458 | 0.66 | APLNR (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023125825-A1 | ANTICORONVIRAL COMPOUNDS AND COMPOSITIONS AND USES THEREOF | SHANGHAI CUREGENE PHARMACEUTICAL CO., LTD. (CN) | 2023-07-06 | — | — | WO | disclosed |