⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22121246 | 0.88 | CES2 (0.31) | — | |
| SCHEMBL22121291 | 0.79 | — | — | |
| SCHEMBL132243 | 0.70 | TSHR (0.32) | — | |
| Acetic Acid SCHEMBL2788321 | 0.69 | TSHR (0.33) | — | |
| Fluoride SCHEMBL22206791 | 0.68 | TSHR (0.32) | — | |
| Hydrochloric Acid SCHEMBL134284 | 0.68 | THRB (0.34) | — | |
| Bromide SCHEMBL22206792 | 0.68 | TSHR (0.32) | — | |
| SCHEMBL22206793 | 0.68 | PARP1 (0.30) | — | |
| SCHEMBL22558903 | 0.67 | — | — | |
| SCHEMBL22558901 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3898592-A1 | HETEROARYL AMIDES USEFUL AS KIF18A INHIBITORS | Amgen Inc. (US) | 2021-10-27 | — | — | EP | disclosed |
| WO-2020132653-A1 | HETEROARYL AMIDES USEFUL AS KIF18A INHIBITORS | AMGEN INC. (US) | 2020-06-25 | — | — | WO | disclosed |