⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8636252 | 0.79 | — | — | |
| SCHEMBL28016169 | 0.67 | — | — | |
| SCHEMBL28498498 | 0.65 | — | — | |
| SCHEMBL29249215 | 0.64 | — | — | |
| SCHEMBL5820520 | 0.64 | HSD11B1 (0.31) | — | |
| SCHEMBL5923548 | 0.64 | HSD11B1 (0.31) | — | |
| SCHEMBL30672155 | 0.62 | KDM4E (0.33) | — | |
| SCHEMBL28439127 | 0.61 | — | — | |
| SCHEMBL28513898 | 0.61 | — | — | |
| SCHEMBL4268607 | 0.61 | — | — |
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-5753659-A | ANTICOAGULANTS FOR BLOOD DISORDER, CARDIOVASCULAR DISORDER, THROMBOSIS, | ZENECA LIMITED (GB) | 1998-05-19 | — | — | US | disclosed |
| US-5728701-A | INHIBIT PLATELET AGGREGATION | ZENECA LIMITED (GB) | 1998-03-17 | — | — | US | disclosed |