⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22758567 | 0.92 | — | — | |
| SCHEMBL21772477 | 0.85 | — | — | |
| SCHEMBL21772478 | 0.85 | — | — | |
| SCHEMBL19586904 | 0.85 | — | — | |
| SCHEMBL23722564 | 0.79 | — | — | |
| SCHEMBL19606061 | 0.78 | CTSK (0.45) | — | |
| SCHEMBL23721439 | 0.78 | — | — | |
| SCHEMBL19605969 | 0.78 | CTSB (0.38) | — | |
| SCHEMBL23722272 | 0.77 | — | — | |
| SCHEMBL24766273 | 0.77 | — | — |
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-2020247665-A1 | PEPTIDOMIMETICS FOR THE TREATMENT OF CORONAVIRUS AND PICORNAVIRUS INFECTIONS | EMORY UNIVERSITY (US) | 2020-12-10 | — | — | WO | disclosed |