⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28258664 | 0.97 | — | — | |
| SCHEMBL525220 | 0.69 | FBP1 (0.38) | — | |
| SCHEMBL7126113 | 0.69 | FBP1 (0.38) | — | |
| SCHEMBL5327434 | 0.69 | FBP1 (0.38) | — | |
| SCHEMBL818125 | 0.69 | — | — | |
| SCHEMBL3239691 | 0.67 | — | — | |
| SCHEMBL1333409 | 0.67 | — | — | |
| SCHEMBL28801587 | 0.65 | — | — | |
| SCHEMBL4514487 | 0.65 | — | — | |
| SCHEMBL17178422 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-110300590-A | TYK2 inhibitor and application thereof | 林伯士拉克许米公司 | 2019-10-01 | — | — | CN | disclosed |