⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17250026 | 0.91 | — | — | |
| SCHEMBL17250027 | 0.88 | — | — | |
| SCHEMBL25485086 | 0.87 | — | — | |
| SCHEMBL25485084 | 0.85 | — | — | |
| SCHEMBL14925709 | 0.84 | — | — | |
| SCHEMBL14925694 | 0.84 | — | — | |
| SCHEMBL16943215 | 0.80 | — | — | |
| SCHEMBL15905930 | 0.79 | — | — | |
| SCHEMBL25485097 | 0.79 | — | — | |
| SCHEMBL16389194 | 0.79 | — | — |
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-10550385-B2 | Post-synthetic orthogonal amidation plus metal catalyzed azide-alkyne cycloaddition click chemistry on siRNA | SIRNA THERAPEUTICS, INC. (US) | 2020-02-04 | — | — | US | disclosed |