⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18270416 | 0.79 | PIK3CD (0.47) | — | |
| SCHEMBL13204764 | 0.79 | PIK3CD (0.38) | — | |
| SCHEMBL20224780 | 0.79 | — | — | |
| SCHEMBL10312573 | 0.78 | HRH3 (0.34) | — | |
| SCHEMBL7863270 | 0.74 | — | — | |
| SCHEMBL18270403 | 0.72 | PIK3CD (0.34) | — | |
| SCHEMBL16219461 | 0.71 | HRH3 (0.31) | — | |
| SCHEMBL18270388 | 0.71 | CYP1A2 (0.42) | — | |
| SCHEMBL20243889 | 0.71 | USP2 (0.53) | — | |
| SCHEMBL10224599 | 0.70 | PIK3CD (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11827656-B2 | Immunoproteasome inhibitors | PRINCIPIA BIOPHARMA INC. (US) | 2023-11-28 | — | — | US | disclosed |
| US-20180155340-A1 | QUINOLONE DERIVATIVES AS FGFR INHIBITORS | PRINCIPIA BIOPHARMA INC. | 2018-06-07 | — | — | US | disclosed |