⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25847011 | 0.75 | — | — | |
| SCHEMBL26556218 | 0.74 | APLNR (0.31) | — | |
| SCHEMBL2600354 | 0.73 | — | — | |
| SCHEMBL16499846 | 0.70 | APLNR (0.32) | — | |
| SCHEMBL23183520 | 0.70 | APLNR (0.33) | — | |
| SCHEMBL9991970 | 0.69 | TSHR (0.39) | — | |
| SCHEMBL18709642 | 0.69 | APLNR (0.33) | — | |
| SCHEMBL1933726 | 0.69 | APLNR (0.31) | — | |
| SCHEMBL17229702 | 0.69 | ADH1B (0.33) | — | |
| SCHEMBL2600356 | 0.69 | MMP1 (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230382889-A1 | COMPOUNDS FOR INHIBITING KIF18A | VOLASTRA THERAPEUTICS, INC. (US) | 2023-11-30 | — | — | US | disclosed |
| US-20230382889-A1 | COMPOUNDS FOR INHIBITING KIF18A | VOLASTRA THERAPEUTICS, INC. (US) | 2023-11-30 | — | — | US | disclosed |