⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23818637 | 0.90 | — | — | |
| SCHEMBL23819113 | 0.90 | — | — | |
| SCHEMBL23819285 | 0.86 | RIPK1 (0.31) | — | |
| SCHEMBL23819068 | 0.85 | BTN3A1 (0.34) | — | |
| SCHEMBL26291688 | 0.85 | BTN3A1 (0.34) | — | |
| SCHEMBL26295572 | 0.85 | EGLN2 (0.31) | — | |
| SCHEMBL23819284 | 0.85 | RIPK1 (0.33) | — | |
| SCHEMBL23818627 | 0.85 | RIPK1 (0.33) | — | |
| SCHEMBL26290919 | 0.85 | BTN3A1 (0.35) | — | |
| SCHEMBL23818486 | 0.84 | — | — |
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-20230295201-A1 | ANTIVIRAL COMPOUNDS | GILEAD SCIENCES, INC. | 2023-09-21 | — | — | US | disclosed |