⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25613413 | 1.00 | — | — | |
| SCHEMBL25627565 | 1.00 | — | — | |
| SCHEMBL3702630 | 0.74 | — | — | |
| SCHEMBL25302147 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL20899713 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL20899714 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL21570155 | 0.71 | — | — | |
| SCHEMBL22613944 | 0.69 | — | — | |
| SCHEMBL584025 | 0.69 | — | — | |
| SCHEMBL2836928 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023091554-A1 | NOVEL HETEROARYL-UREA COMPOUNDS AS KV7.2 INHIBITORS | ICAGEN, LLC (US) | 2023-05-25 | — | — | WO | disclosed |
| WO-2021142420-A1 | PYRAZOLO[1,5-a]PYRIMIDIN-7(4H)-ONE INHIBITORS OF DYNEIN | KAPOOR TARUN M (US) | 2021-07-15 | — | — | WO | disclosed |