⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4458205 | 1.00 | — | — | |
| SCHEMBL16889289 | 1.00 | — | — | |
| SCHEMBL14561267 | 1.00 | — | — | |
| SCHEMBL10110585 | 1.00 | — | — | |
| SCHEMBL8749742 | 0.85 | KAT2A (0.36) | — | |
| SCHEMBL18595160 | 0.82 | — | — | |
| SCHEMBL16885210 | 0.82 | — | — | |
| SCHEMBL5451969 | 0.79 | IRAK4 (0.34) | — | |
| SCHEMBL9403817 | 0.79 | PRKCA (0.31) | — | |
| SCHEMBL17037487 | 0.79 | — | — |
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-9242984-B2 | Pyrazolyl derivatives as Syk inhibitors | MERCK SHARP & DOHME CORP. (US) | 2016-01-26 | — | — | US | disclosed |
| US-20150191461-A1 | PYRAZOLYL DERIVATIVES AS SYK INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2015-07-09 | — | — | US | disclosed |