⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4049374 | 0.72 | LMNA (0.33) | — | |
| Ammonia Solution, Strong SCHEMBL3820514 | 0.71 | LMNA (0.33) | — | |
| SCHEMBL27143137 | 0.62 | ERN1 (0.31) | — | |
| SCHEMBL2146867 | 0.61 | MAOB (0.33) | — | |
| SCHEMBL15332907 | 0.55 | ALDH1A1 (0.33) | — | |
| SCHEMBL21505559 | 0.53 | CCNT1 (0.32) | — | |
| SCHEMBL27739738 | 0.52 | — | — | |
| SCHEMBL250648 | 0.52 | — | — | |
| SCHEMBL31378876 | 0.52 | ERN1 (0.36) | — | |
| SCHEMBL3686261 | 0.52 | ERN1 (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1824825-A4 | SUBSTITUTED PYRIDOXINES AS ANTI-PLATELET AGENTS | MEDICURE INT INC (BB) | 2009-07-08 | — | — | EP | disclosed |
| EP-1824825-A1 | SUBSTITUTED PYRIDOXINES AS ANTI-PLATELET AGENTS | Medicure International Inc. (BB) | 2007-08-29 | — | — | EP | disclosed |
| WO-2006045203-A1 | SUBSTITUTED PYRIDOXINES AS ANTI-PLATELET AGENTS | MEDICURE INTERNATIONAL INC. (CA) | 2006-05-04 | — | — | WO | disclosed |