⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL974185 | 0.77 | — | — | |
| SCHEMBL27541402 | 0.77 | — | — | |
| SCHEMBL8590380 | 0.76 | — | — | |
| SCHEMBL6200461 | 0.74 | — | — | |
| SCHEMBL777881 | 0.73 | TDP1 (0.33) | — | |
| SCHEMBL16363530 | 0.73 | TDP1 (0.33) | — | |
| SCHEMBL10881185 | 0.72 | — | — | |
| SCHEMBL6200787 | 0.72 | — | — | |
| SCHEMBL6973009 | 0.71 | — | — | |
| SCHEMBL9363795 | 0.69 | — | — |
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-4845100-A | WITH HYPOTENSIVE AND ANTIINFLAMMATORY ACTIVITY | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1989-07-04 | — | — | US | disclosed |
| EP-0202760-A2 | Carbostyril derivatives and salts thereof, processes for preparing the same and cardiotonic composition containing the same | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1986-11-26 | — | — | EP | disclosed |