⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL22771604 | 0.97 | KDM1A (0.52) | — | |
| Hydrochloric Acid SCHEMBL22771605 | 0.97 | KDM1A (0.52) | — | |
| SCHEMBL8925246 | 0.91 | KDM1A (0.57) | — | |
| SCHEMBL15787851 | 0.84 | KDM1A (0.58) | — | |
| Hydrochloric Acid SCHEMBL22575426 | 0.82 | KDM1A (0.60) | — | |
| Hydrochloric Acid SCHEMBL22575428 | 0.82 | KDM1A (0.60) | — | |
| SCHEMBL428790 | 0.82 | KDM1A (0.46) | — | |
| SCHEMBL428791 | 0.82 | KDM1A (0.46) | — | |
| SCHEMBL22473042 | 0.81 | KDM1A (0.48) | — | |
| SCHEMBL8637664 | 0.81 | KDM1A (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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0450066-B1 | CARBOSTYRIL DERIVATIVES | OTSUKA PHARMA CO LTD (JP) | 1996-09-11 | — | — | EP | disclosed |
| US-5401740-A | FOR INHIBITING PLATELET AGGREGATION | OTSUKA PHARMACEUTICAL CO. (JP) | 1995-03-28 | — | — | US | disclosed |
| US-5227381-A | Anticoagulant | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1993-07-13 | — | — | US | disclosed |
| EP-0450066-A1 | CARBOSTYRIL DERIVATIVES | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1991-10-09 | — | — | EP | disclosed |