⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13588389 | 0.82 | ADORA3 (0.35) | — | |
| SCHEMBL4390017 | 0.76 | UHRF1 (0.37) | — | |
| SCHEMBL1457529 | 0.73 | PDPK1 (0.33) | — | |
| SCHEMBL22411485 | 0.66 | KDM4E (0.38) | — | |
| SCHEMBL16916437 | 0.64 | KDM4E (0.32) | — | |
| SCHEMBL5805904 | 0.62 | — | — | |
| SCHEMBL12165336 | 0.60 | — | — | |
| SCHEMBL24005566 | 0.58 | UHRF1 (0.45) | — | |
| SCHEMBL16916195 | 0.58 | LIMK1 (0.36) | — | |
| SCHEMBL4382959 | 0.58 | CLK1 (0.36) | — |
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-8329721-B2 | Hydroxy and alkoxy substituted 1H-imidazonaphthyridines and methods | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2012-12-11 | — | — | US | disclosed |
| US-20090298821-A1 | HYDROXY AND ALKOXY SUBSTITUTED IH-IMIDAZONAPHTHYRIDINES AND METHODS | PFIZER INC. | 2009-12-03 | — | — | US | disclosed |
| WO-2007106854-A2 | HYDROXY AND ALKOXY SUBSTITUTED 1H-IMIDAZONAPHTHYRIDINES AND METHODS | COLEY PHARMACEUTICAL GROUP, INC. (US) | 2007-09-20 | — | — | WO | disclosed |