⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22201937 | 0.77 | GSK3A (0.30) | — | |
| SCHEMBL1585767 | 0.77 | RET (0.35) | — | |
| SCHEMBL27215058 | 0.76 | DYRK1B (0.41) | — | |
| SCHEMBL21893429 | 0.76 | JAK2 (0.32) | — | |
| SCHEMBL1496185 | 0.76 | GSK3B (0.36) | — | |
| SCHEMBL23247356 | 0.72 | PRMT5 (0.40) | — | |
| SCHEMBL30068587 | 0.72 | PRMT5 (0.40) | — | |
| SCHEMBL1496186 | 0.70 | ALDH1A1 (0.39) | — | |
| SCHEMBL25896492 | 0.69 | CA1 (0.31) | — | |
| SCHEMBL25523782 | 0.69 | CA1 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108602799-B | Kinase inhibitor | 上海复尚慧创医药研究有限公司 | 2021-08-03 | — | — | CN | disclosed |
| WO-2017133701-A1 | CERTAIN PROTEIN KINASE INHIBITORS | SHANGHAI FOCHON PHARMACEUTICAL CO., LTD. (CN) | 2017-08-10 | — | — | WO | disclosed |