⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26558095 | 0.89 | — | — | |
| SCHEMBL26558134 | 0.87 | SMN1; SMN2 (0.32) | — | |
| SCHEMBL26558178 | 0.84 | TSHR (0.32) | — | |
| SCHEMBL26558137 | 0.84 | SMN1; SMN2 (0.30) | — | |
| SCHEMBL26558138 | 0.84 | SMN1; SMN2 (0.30) | — | |
| SCHEMBL26558143 | 0.83 | SMYD2 (0.33) | — | |
| SCHEMBL26558118 | 0.82 | ALDH1A1 (0.34) | — | |
| SCHEMBL26557819 | 0.82 | SMN1; SMN2 (0.33) | — | |
| SCHEMBL26558122 | 0.81 | TOP2A (0.33) | — | |
| SCHEMBL26558147 | 0.81 | — | — |
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-20230331751-A1 | STEREOSELECTIVE MANUFACTURE OF SELECTED PURINE PHOSPHORAMIDATES | Atea Pharmaceuticals, Inc. (US) | 2023-10-19 | — | — | US | disclosed |