⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21497263 | 1.00 | — | — | |
| SCHEMBL21921096 | 0.79 | — | — | |
| SCHEMBL13344001 | 0.75 | — | — | |
| SCHEMBL18513528 | 0.72 | — | — | |
| SCHEMBL29141763 | 0.72 | — | — | |
| SCHEMBL22838373 | 0.71 | — | — | |
| SCHEMBL18513512 | 0.71 | — | — | |
| SCHEMBL14015905 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL19926499 | 0.70 | GABRP (0.32) | — | |
| Hydrochloric Acid SCHEMBL19926498 | 0.70 | GABRP (0.32) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019202611-A1 | AN IMPROVED PROCESS FOR THE SYNTHESIS OF IVABRADINE AND ITS PHARMACEUTICALLY ACCEPTABLE SALTS | METROCHEM API PVT (IN) | 2019-10-24 | — | — | WO | claimed |
| WO-2019202611-A1 | AN IMPROVED PROCESS FOR THE SYNTHESIS OF IVABRADINE AND ITS PHARMACEUTICALLY ACCEPTABLE SALTS | METROCHEM API PVT (IN) | 2019-10-24 | — | — | WO | disclosed |