⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1704473 | 0.79 | — | — | |
| SCHEMBL14666393 | 0.74 | — | — | |
| SCHEMBL29260366 | 0.74 | — | — | |
| SCHEMBL29143672 | 0.74 | — | — | |
| SCHEMBL2708465 | 0.74 | NLRP3 (0.35) | — | |
| SCHEMBL14666431 | 0.74 | — | — | |
| SCHEMBL27498061 | 0.74 | — | — | |
| SCHEMBL29260368 | 0.74 | — | — | |
| SCHEMBL15354731 | 0.72 | NLRP3 (0.33) | — | |
| SCHEMBL5637131 | 0.72 | NLRP3 (0.33) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0382185-A2 | Carbostyril derivatives | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1990-08-16 | — | — | EP | disclosed |