⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24755492 | 0.89 | CTSL (0.44) | — | |
| SCHEMBL29179605 | 0.89 | CTSL (0.44) | — | |
| SCHEMBL24710112 | 0.89 | CTSL (0.44) | — | |
| SCHEMBL24190098 | 0.88 | — | — | |
| SCHEMBL8278850 | 0.88 | CTSL (0.41) | — | |
| SCHEMBL8276856 | 0.88 | — | — | |
| SCHEMBL23824539 | 0.88 | CTSL (0.41) | — | |
| SCHEMBL23824538 | 0.88 | CTSL (0.41) | — | |
| SCHEMBL8278581 | 0.88 | — | — | |
| SCHEMBL29179614 | 0.88 | CTSV (0.52) | — |
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-2023055702-A1 | MAIN PROTEASE (M PRO) INHIBITORS AND METHODS USING SAME | ARBUTUS BIOPHARMA CORPORATION (CA) | 2023-04-06 | — | — | WO | disclosed |