⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31681403 | 1.00 | — | — | |
| SCHEMBL22425795 | 0.90 | — | — | |
| SCHEMBL29684175 | 0.90 | — | — | |
| SCHEMBL22411868 | 0.86 | P2RX3 (0.32) | — | |
| SCHEMBL22411869 | 0.86 | P2RX3 (0.32) | — | |
| SCHEMBL24500844 | 0.82 | CSNK1D (0.30) | — | |
| SCHEMBL29683954 | 0.81 | ALDH1A1 (0.32) | — | |
| SCHEMBL22425986 | 0.81 | CSNK1D (0.31) | — | |
| SCHEMBL22412064 | 0.81 | CSNK1D (0.31) | — | |
| SCHEMBL22411825 | 0.80 | LMNA (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20220177486-A1 | TYK2 INHIBITORS AND USES THEREOF | ALUMIS INC. | 2022-06-09 | — | — | US | disclosed |
| EP-3938369-A1 | TYK2 INHIBITORS AND USES THEREOF | Esker Therapeutics, Inc. (US) | 2022-01-19 | — | — | EP | disclosed |
| WO-2020185755-A1 | TYK2 INHIBITORS AND USES THEREOF | FRONTHERA U.S. PHARMACEUTICALS LLC (US) | 2020-09-17 | — | — | WO | disclosed |