⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13732302 | 0.74 | — | — | |
| SCHEMBL1139842 | 0.70 | FFAR3 (0.35) | — | |
| SCHEMBL21488423 | 0.66 | — | — | |
| SCHEMBL14910753 | 0.65 | — | — | |
| SCHEMBL1722705 | 0.65 | — | — | |
| SCHEMBL2085807 | 0.64 | — | — | |
| SCHEMBL2725107 | 0.64 | TSHR (0.31) | — | |
| SCHEMBL2166022 | 0.63 | KDM4E (0.32) | — | |
| SCHEMBL22346155 | 0.63 | — | — | |
| SCHEMBL16823316 | 0.63 | — | — |
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 |