⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9208043 | 0.92 | — | — | |
| SCHEMBL9203516 | 0.89 | — | — | |
| SCHEMBL9200778 | 0.88 | — | — | |
| SCHEMBL9200788 | 0.88 | — | — | |
| SCHEMBL9284533 | 0.85 | — | — | |
| SCHEMBL9204399 | 0.84 | ABCC1 (0.68) | — | |
| SCHEMBL9204404 | 0.84 | ABCC1 (0.68) | — | |
| SCHEMBL9281256 | 0.84 | — | — | |
| SCHEMBL9209227 | 0.84 | — | — | |
| SCHEMBL10590033 | 0.83 | — | — |
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-0318093-A2 | Diarylquinoline diacids and their use as medicaments | MERCK FROSST CANADA INC. (CA) | 1989-05-31 | — | — | EP | claimed |