⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26240578 | 0.89 | GRM5 (0.32) | — | |
| SCHEMBL26827016 | 0.87 | POLRMT (0.39) | — | |
| SCHEMBL26823192 | 0.87 | TMPRSS2 (0.34) | — | |
| SCHEMBL26833989 | 0.86 | — | — | |
| SCHEMBL26240621 | 0.81 | — | — | |
| SCHEMBL26229754 | 0.81 | — | — | |
| SCHEMBL25393896 | 0.80 | TMPRSS2 (0.34) | — | |
| SCHEMBL26240604 | 0.78 | POLRMT (0.38) | — | |
| SCHEMBL26823184 | 0.77 | TMPRSS2 (0.34) | — | |
| SCHEMBL23818965 | 0.77 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230382940-A1 | ANTIVIRAL COMPOUNDS AND METHODS OF MAKING AND USING THE SAME | GILEAD SCIENCES, INC. | 2023-11-30 | — | — | US | disclosed |