⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28198669 | 0.74 | — | — | |
| SCHEMBL29549708 | 0.71 | — | — | |
| SCHEMBL194096 | 0.71 | — | — | |
| SCHEMBL19244567 | 0.67 | TDP1 (0.44) | — | |
| SCHEMBL23932248 | 0.67 | — | — | |
| SCHEMBL2646498 | 0.67 | — | — | |
| SCHEMBL30930706 | 0.67 | — | — | |
| SCHEMBL14074055 | 0.67 | — | — | |
| SCHEMBL10321593 | 0.67 | — | — | |
| SCHEMBL31387813 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-114981256-A | Single-ring agonists of the interferon gene stimulator STING | 斯克里普斯研究学院 | 2022-08-30 | — | — | CN | disclosed |