⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL257425 | 1.00 | — | — | |
| SCHEMBL13843311 | 1.00 | — | — | |
| SCHEMBL682533 | 0.71 | — | — | |
| SCHEMBL14423114 | 0.71 | — | — | |
| SCHEMBL14423115 | 0.71 | — | — | |
| SCHEMBL5973258 | 0.71 | — | — | |
| SCHEMBL10023139 | 0.71 | — | — | |
| SCHEMBL2577802 | 0.71 | — | — | |
| SCHEMBL31469120 | 0.67 | — | — | |
| SCHEMBL12796563 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2609091-B1 | PHARMACEUTICALLY ACTIVE COMPOUNDS AS AXL INHIBITORS | LEAD DISCOVERY CENTER GMBH (DE) | 2014-11-26 | — | — | EP | disclosed |
| US-20080207677-A1 | Napthyridine Compounds As Rock Inhibitors | GPC BIOTECH AG (DE) | 2008-08-28 | — | — | US | disclosed |