⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14152524 | 0.74 | ALOX5 (0.39) | — | |
| SCHEMBL27875752 | 0.74 | — | — | |
| SCHEMBL5524502 | 0.72 | ALOX5 (0.37) | — | |
| SCHEMBL117079 | 0.71 | LIPA (0.31) | — | |
| SCHEMBL22342332 | 0.69 | FAAH (0.37) | — | |
| SCHEMBL9046464 | 0.69 | TRPM8 (0.30) | — | |
| SCHEMBL9046471 | 0.69 | TRPM8 (0.30) | — | |
| SCHEMBL14889676 | 0.68 | ALOX5 (0.43) | — | |
| SCHEMBL17064819 | 0.68 | MEN1 (0.35) | — | |
| SCHEMBL19746226 | 0.67 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114835705-A | Heterocyclic compound and application thereof in medicine | 杭州安道药业有限公司 | 2022-08-02 | — | — | CN | disclosed |
| CN-109776523-B | Heterocyclic compound and application thereof in medicine | 杭州安道药业有限公司 | 2022-04-15 | — | — | CN | disclosed |
| US-11236088-B2 | Heterocyclic compounds and their application in medicine | KIND PHARMACEUTICAL (CN) | 2022-02-01 | — | — | US | disclosed |
| US-20210179609-A1 | HETEROCYCLIC COMPOUNDS AND THEIR APPLICATION IN MEDICINE | KIND PHARMACEUTICAL (CN) | 2021-06-17 | — | — | US | disclosed |
| EP-3696178-A1 | HETEROCYCLIC COMPOUND AND APPLICATION THEREOF IN MEDICINE | Anlin Pharmaceuticals, LLC (CN) | 2020-08-19 | — | — | EP | disclosed |