⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26336893 | 1.00 | — | — | |
| SCHEMBL23819050 | 0.93 | RIPK1 (0.32) | — | |
| SCHEMBL26345083 | 0.92 | BTN3A1 (0.34) | — | |
| SCHEMBL23818947 | 0.90 | RIPK1 (0.31) | — | |
| SCHEMBL23819343 | 0.89 | — | — | |
| SCHEMBL26333768 | 0.89 | — | — | |
| SCHEMBL23819096 | 0.86 | BTN3A1 (0.35) | — | |
| SCHEMBL26334498 | 0.85 | — | — | |
| SCHEMBL23819315 | 0.84 | BTN3A1 (0.34) | — | |
| SCHEMBL23819003 | 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-20210284670-A1 | ANTIVIRAL COMPOUNDS | GILEAD SCIENCES, INC. | 2021-09-16 | — | — | US | disclosed |