⚠ 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL29290550 | 0.71 | NEK2 (0.33) | — | |
| Lithium SCHEMBL30306385 | 0.71 | NEK2 (0.33) | — | |
| SCHEMBL30660753 | 0.71 | NEK2 (0.33) | — | |
| SCHEMBL5176480 | 0.71 | — | — | |
| SCHEMBL4345473 | 0.71 | — | — | |
| Methane SCHEMBL28226016 | 0.71 | NEK2 (0.33) | — | |
| SCHEMBL11954686 | 0.68 | — | — | |
| SCHEMBL7388427 | 0.67 | — | — | |
| SCHEMBL23163190 | 0.67 | ERBB2 (0.35) | — | |
| SCHEMBL11124755 | 0.67 | CSNK2A1 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2009002-A1 | New process for the manufacture of 1H-imidazo [4,5-c]-quinoline ring systems | INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) | 2008-12-31 | — | — | EP | disclosed |
| WO-2008155745-A2 | NEW PROCESS FOR THE MANUFACTURE OF 1H-IMIDAZO[4,5-C]-QUINOLINE RING SYSTEMS | INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) | 2008-12-24 | — | — | WO | disclosed |