⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10141577 | 0.85 | NLRP3 (0.31) | — | |
| SCHEMBL10141576 | 0.78 | SIGMAR1 (0.34) | — | |
| SCHEMBL18250315 | 0.78 | SIGMAR1 (0.37) | — | |
| SCHEMBL25364854 | 0.77 | FAAH (0.33) | — | |
| SCHEMBL18250269 | 0.76 | SIGMAR1 (0.39) | — | |
| SCHEMBL21267698 | 0.75 | IRAK4 (0.36) | — | |
| SCHEMBL23107815 | 0.74 | FAAH (0.40) | — | |
| SCHEMBL12505515 | 0.74 | INSR (0.36) | — | |
| SCHEMBL26765386 | 0.74 | KDM4E (0.35) | — | |
| SCHEMBL24291946 | 0.73 | SIGMAR1 (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230355626-A1 | INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION | VIIV HEALTHCARE UK (NO. 5) LIMITED (GB) | 2023-11-09 | — | — | US | disclosed |
| US-20230013823-A1 | INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION | VIIV HEALTHCARE UK (NO. 5) LIMITED (GB) | 2023-01-19 | — | — | US | disclosed |
| US-20220389007-A1 | INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION | VIIV HEALTHCARE UK (NO. 5) LIMITED (GB) | 2022-12-08 | — | — | US | disclosed |