⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL185652 | 0.82 | — | — | |
| SCHEMBL3720185 | 0.79 | SLC6A2 (0.35) | — | |
| SCHEMBL2314755 | 0.79 | SLC6A2 (0.36) | — | |
| SCHEMBL197401 | 0.77 | — | — | |
| SCHEMBL146478 | 0.77 | SLC6A2 (0.33) | — | |
| SCHEMBL72779 | 0.77 | SLC6A2 (0.39) | — | |
| SCHEMBL2447937 | 0.77 | SLC6A2 (0.33) | — | |
| SCHEMBL16985363 | 0.76 | — | — | |
| SCHEMBL11572913 | 0.76 | SLC6A2 (0.40) | — | |
| SCHEMBL516648 | 0.76 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021214785-A1 | IMPROVED PROCESS FOR THE PREPARATION OF ROXADUSTAT | MYLAN LABORATORIES LIMITED (IN) | 2021-10-28 | — | — | WO | disclosed |