⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24815857 | 0.75 | — | — | |
| SCHEMBL21620908 | 0.72 | — | — | |
| SCHEMBL14769574 | 0.69 | — | — | |
| SCHEMBL24815830 | 0.68 | LMNA (0.31) | — | |
| SCHEMBL24815822 | 0.68 | TSHR (0.30) | — | |
| SCHEMBL15786340 | 0.67 | — | — | |
| SCHEMBL25291433 | 0.67 | TP53 (0.36) | — | |
| SCHEMBL27840594 | 0.65 | — | — | |
| SCHEMBL24815634 | 0.65 | — | — | |
| SCHEMBL19302257 | 0.63 | TP53 (0.34) | — |
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-2022268230-A1 | COMPOUND AS KIF18A INHIBITOR | 杭州英创医药科技有限公司 | 2022-12-29 | — | — | WO | disclosed |