⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23502420 | 0.81 | — | — | |
| SCHEMBL26709132 | 0.76 | — | — | |
| SCHEMBL21033545 | 0.74 | — | — | |
| SCHEMBL25547692 | 0.72 | KDM4E (0.31) | — | |
| SCHEMBL24070527 | 0.70 | CHRM2 (0.31) | — | |
| SCHEMBL21134598 | 0.68 | SLC6A4 (0.33) | — | |
| SCHEMBL19321833 | 0.68 | KDM1A (0.33) | — | |
| SCHEMBL21134592 | 0.68 | SLC6A4 (0.33) | — | |
| SCHEMBL7732887 | 0.68 | SLC6A4 (0.33) | — | |
| SCHEMBL21033452 | 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 |
|---|---|---|---|---|---|---|---|
| WO-2022166860-A1 | PIM KINASE INHIBITOR | 杭州邦顺制药有限公司 | 2022-08-11 | — | — | WO | disclosed |