⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22114075 | 0.76 | — | — | |
| SCHEMBL22114070 | 0.68 | METAP1 (0.33) | — | |
| SCHEMBL29172186 | 0.59 | IDO1 (0.36) | — | |
| SCHEMBL22335497 | 0.56 | — | — | |
| SCHEMBL22335500 | 0.56 | — | — | |
| SCHEMBL24126220 | 0.56 | — | — | |
| SCHEMBL22866751 | 0.55 | — | — | |
| SCHEMBL30453457 | 0.54 | PRKCG (0.32) | — | |
| SCHEMBL13291388 | 0.53 | INPPL1 (0.35) | — | |
| SCHEMBL24253313 | 0.53 | PTPRC (0.33) | — |
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-2020123674-A1 | SUBSTITUTED ARYLMETHYLUREAS AND HETEROARYLMETHYLUREAS, ANALOGUES THEREOF, AND METHODS USING SAME | ARBUTUS BIOPHARMA CORPORATION (CA) | 2020-06-18 | — | — | WO | disclosed |