⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6596358 | 0.79 | TSHR (0.42) | — | |
| SCHEMBL28811244 | 0.78 | TSHR (0.41) | — | |
| SCHEMBL6611215 | 0.73 | MAOA (0.40) | — | |
| SCHEMBL2408107 | 0.72 | TSHR (0.44) | — | |
| SCHEMBL22042223 | 0.69 | TSHR (0.50) | — | |
| SCHEMBL6614153 | 0.67 | MAOA (0.41) | — | |
| Hydrochloric Acid SCHEMBL9722602 | 0.66 | TBXAS1 (0.42) | — | |
| SCHEMBL11202793 | 0.65 | TSHR (0.37) | — | |
| SCHEMBL7295713 | 0.65 | TSHR (0.41) | — | |
| SCHEMBL6057523 | 0.65 | TSHR (0.32) | — |
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-0273444-B1 | USE OF CARBOXAMIDE COMPOUNDS FOR THE PREPARATION OF A MEDICAMENT FOR TREATING HYPERLIPIDEMIA | OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) | 1993-05-05 | — | — | EP | disclosed |