⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL56618 | 0.89 | — | — | |
| SCHEMBL334621 | 0.76 | — | — | |
| SCHEMBL743262 | 0.73 | — | — | |
| SCHEMBL1000740 | 0.72 | — | — | |
| SCHEMBL28347353 | 0.72 | — | — | |
| SCHEMBL9638785 | 0.70 | NISCH (0.32) | — | |
| SCHEMBL142906 | 0.69 | — | — | |
| Methylamine SCHEMBL8761530 | 0.69 | — | — | |
| SCHEMBL312465 | 0.68 | — | — | |
| SCHEMBL9425544 | 0.68 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20030055092-A1 | Remedies for ischemic stroke | YAMANOUCHI PHARMACEUTICAL CO., LTD. | 2003-03-20 | — | — | US | disclosed |
| EP-1059090-A1 | REMEDIES FOR BRAIN INFARCTION | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 2000-12-13 | — | — | EP | disclosed |