⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL788917 | 0.84 | PKN1 (0.33) | — | |
| SCHEMBL31268919 | 0.84 | HSD17B10 (0.40) | — | |
| SCHEMBL12503869 | 0.84 | HSD17B10 (0.40) | — | |
| SCHEMBL31339136 | 0.80 | CSNK2A1 (0.39) | — | |
| SCHEMBL13134193 | 0.76 | EGFR (0.30) | — | |
| SCHEMBL788381 | 0.73 | LOXL2 (0.39) | — | |
| SCHEMBL4521139 | 0.72 | METAP2 (0.42) | — | |
| SCHEMBL1021063 | 0.72 | EGFR (0.33) | — | |
| SCHEMBL2011130 | 0.72 | EGFR (0.33) | — | |
| SCHEMBL277594 | 0.72 | EGFR (0.33) | — |
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-20090233960-A1 | Kinase Inhibitors | DEVGEN NV (BE) | 2009-09-17 | — | — | US | disclosed |
| EP-1934181-A2 | KINASE INHIBITORS | Devgen NV (BE) | 2008-06-25 | — | — | EP | disclosed |
| WO-2007042321-A2 | KINASE INHIBITORS | DEVGEN N.V. (BE) | 2007-04-19 | — | — | WO | disclosed |