⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24235431 | 0.83 | PTGER3 (0.35) | — | |
| SCHEMBL6732243 | 0.81 | AR (0.44) | — | |
| SCHEMBL24235351 | 0.79 | — | — | |
| SCHEMBL25264535 | 0.79 | — | — | |
| SCHEMBL23721419 | 0.79 | — | — | |
| SCHEMBL25264534 | 0.79 | — | — | |
| SCHEMBL24235515 | 0.78 | — | — | |
| SCHEMBL25134614 | 0.78 | PTGER3 (0.35) | — | |
| SCHEMBL25006853 | 0.76 | PTGER3 (0.34) | — | |
| SCHEMBL24113100 | 0.75 | PTGER3 (0.34) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11859014-B2 | Peptidomimetics for the treatment of Norovirus infection | EMORY UNIVERSITY (US) | 2024-01-02 | — | — | US | disclosed |
| WO-2023055702-A1 | MAIN PROTEASE (M PRO) INHIBITORS AND METHODS USING SAME | ARBUTUS BIOPHARMA CORPORATION (CA) | 2023-04-06 | — | — | WO | disclosed |
| WO-2022268111-A1 | ANTIVIRAL PHARMACEUTICAL COMPOSITION, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 前沿生物药业(南京)股份有限公司 | 2022-12-29 | — | — | WO | disclosed |
| WO-2021151265-A1 | PHARMACEUTICAL USE OF ALDEHYDE-BASED COMPOUND | 中国科学院上海药物研究所 | 2021-08-05 | — | — | WO | disclosed |