⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26404967 | 0.93 | RIPK1 (0.30) | — | |
| SCHEMBL26317626 | 0.90 | — | — | |
| SCHEMBL26325804 | 0.73 | FAP (0.31) | — | |
| SCHEMBL26325762 | 0.72 | — | — | |
| SCHEMBL26325789 | 0.72 | — | — | |
| SCHEMBL26325783 | 0.70 | — | — | |
| SCHEMBL26325771 | 0.69 | — | — | |
| SCHEMBL26316679 | 0.69 | RIPK1 (0.31) | — | |
| SCHEMBL26317120 | 0.69 | RIPK1 (0.31) | — | |
| SCHEMBL27284023 | 0.67 | RIPK1 (0.36) | — |
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-20230279014-A1 | COMPOUNDS AND METHODS FOR TREATMENT OF VIRAL INFECTIONS | GILEAD SCIENCES, INC. | 2023-09-07 | — | — | US | disclosed |