⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23824437 | 0.86 | CTSL (0.37) | — | |
| SCHEMBL23824440 | 0.86 | CTSL (0.37) | — | |
| SCHEMBL23824442 | 0.86 | CTSL (0.37) | — | |
| SCHEMBL23506393 | 0.85 | CTSL (0.39) | — | |
| SCHEMBL30823567 | 0.83 | NOD1 (0.41) | — | |
| SCHEMBL24690554 | 0.82 | — | — | |
| SCHEMBL21702235 | 0.81 | CTSL (0.42) | — | |
| SCHEMBL23836465 | 0.81 | CTSL (0.36) | — | |
| SCHEMBL25134601 | 0.81 | CTSL (0.36) | — | |
| SCHEMBL24696826 | 0.81 | CTSL (0.39) | — |
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-2022256434-A1 | PROTEASE INHIBITORS AS ANTIVIRALS | ACEA Therapeutics, Inc. (US) | 2022-12-08 | — | — | WO | disclosed |