⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3627165 | 0.85 | KDM4E (0.32) | — | |
| SCHEMBL23019235 | 0.82 | CHRM2 (0.32) | — | |
| SCHEMBL26598817 | 0.79 | SLC6A4 (0.35) | — | |
| SCHEMBL11643831 | 0.79 | NCF1 (0.38) | — | |
| SCHEMBL419710 | 0.79 | — | — | |
| SCHEMBL21387094 | 0.77 | — | — | |
| SCHEMBL19231907 | 0.76 | — | — | |
| SCHEMBL6124708 | 0.76 | DPP4 (0.46) | — | |
| SCHEMBL13593722 | 0.76 | ALDH1A1 (0.33) | — | |
| SCHEMBL24259200 | 0.74 | CYP1A2 (0.34) | — |
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-2021159372-A1 | USE OF JAK INHIBITORS IN PREPARATION OF DRUGS FOR TREATING JAK KINASE-RELATED DISEASES | 珠海联邦制药股份有限公司 | 2021-08-19 | — | — | WO | disclosed |