⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24113346 | 0.92 | CTSL (0.47) | — | |
| SCHEMBL24740251 | 0.87 | — | — | |
| SCHEMBL24113375 | 0.84 | CTSS (0.46) | — | |
| SCHEMBL24020754 | 0.82 | — | — | |
| SCHEMBL24112532 | 0.82 | CTSS (0.51) | — | |
| SCHEMBL28839694 | 0.82 | CTSS (0.51) | — | |
| SCHEMBL25761959 | 0.82 | CTSL (0.55) | — | |
| SCHEMBL24020458 | 0.82 | CTSS (0.51) | — | |
| SCHEMBL24021038 | 0.82 | CTSL (0.49) | — | |
| SCHEMBL24019848 | 0.81 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11760722-B2 | Inhibitors of cysteine proteases and methods of use thereof | ASCLETIS BIOSCIENCE CO., LTD. (CN) | 2023-09-19 | — | — | US | disclosed |
| US-20230234921-A1 | INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF | ASCLETIS BIOSCIENCE CO., LTD. (CN) | 2023-07-27 | — | — | US | disclosed |
| US-20230159451-A1 | INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF | ASCLETIS BIOSCIENCE CO., LTD. (CN) | 2023-05-25 | — | — | US | disclosed |