⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23750654 | 0.76 | — | — | |
| SCHEMBL23699031 | 0.76 | — | — | |
| SCHEMBL17974820 | 0.69 | — | — | |
| SCHEMBL2625551 | 0.66 | — | — | |
| SCHEMBL18876676 | 0.66 | SLC7A5 (0.45) | — | |
| SCHEMBL11041173 | 0.66 | — | — | |
| SCHEMBL2625535 | 0.66 | — | — | |
| SCHEMBL577114 | 0.65 | — | — | |
| SCHEMBL21585503 | 0.65 | — | — | |
| SCHEMBL3111994 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022174179-A9 | 4'-HALOGEN CONTAINING NUCLEOTIDE AND NUCLEOSIDE THERAPEUTIC COMPOSITIONS AND USES RELATED THERETO | EMORY UNIVERSITY (US) | 2023-02-02 | — | — | WO | disclosed |