⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12346272 | 0.85 | CA2 (0.31) | — | |
| SCHEMBL11689911 | 0.82 | — | — | |
| SCHEMBL11961384 | 0.75 | LMNA (0.33) | — | |
| SCHEMBL8283545 | 0.74 | — | — | |
| SCHEMBL584979 | 0.74 | — | — | |
| SCHEMBL584980 | 0.74 | — | — | |
| SCHEMBL584981 | 0.74 | — | — | |
| Methoxymethane SCHEMBL6931781 | 0.72 | — | — | |
| SCHEMBL12786955 | 0.72 | — | — | |
| SCHEMBL10071432 | 0.72 | SMN1; SMN2 (0.30) | — |
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-20110275655-A1 | PYRIMIDINECARBOXAMIDE DERIVATIVES AS INHIBITORS OF SYK KINASE | GLAXO GROUP LIMITED (GB) | 2011-11-10 | — | — | US | disclosed |
| WO-2010097248-A1 | PYRIMIDINECARBOXAMIDE DERIVATIVES AS INHIBITORS OF SYK KINASE | GLAXO GROUP LIMITED (GB) | 2010-09-02 | — | — | WO | disclosed |
| WO-2004072034-A1 | PIPERIDINE-BENZENESULFONAMIDE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2004-08-26 | — | — | WO | disclosed |