⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL85820 | 0.72 | GRM5 (0.44) | — | |
| SCHEMBL468941 | 0.72 | — | — | |
| SCHEMBL22215300 | 0.71 | SMN1; SMN2 (0.36) | — | |
| SCHEMBL18000492 | 0.70 | — | — | |
| SCHEMBL20843934 | 0.70 | — | — | |
| SCHEMBL14425145 | 0.70 | — | — | |
| SCHEMBL1012703 | 0.70 | — | — | |
| SCHEMBL20375530 | 0.70 | — | — | |
| SCHEMBL21341850 | 0.69 | — | — | |
| SCHEMBL25979186 | 0.68 | SMN1; SMN2 (0.43) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024130341-A1 | BENZIMIDAZOLE DERIVATIVES FOR THE MODULATION OF STING | Aculeus Therapeutics Pty Ltd (AU) | 2024-06-27 | — | — | WO | disclosed |
| US-20210040092-A1 | INHIBITORS OF INFLUENZA VIRUSES REPLICATION | VERTEX PHARMACEUTICALS INCORPORATED | 2021-02-11 | — | — | US | disclosed |
| WO-2020153433-A1 | SUBSTITUENT-INCLUDING UREA COMPOUND | 第一三共株式会社 | 2020-07-30 | — | — | WO | disclosed |
| US-9908878-B2 | Inhibitors of influenza viruses replication | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2018-03-06 | — | — | US | disclosed |