⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10602658 | 0.45 | — | — | |
| SCHEMBL16618178 | 0.45 | — | — | |
| SCHEMBL3754347 | 0.43 | — | — | |
| SCHEMBL17717531 | 0.41 | — | — | |
| SCHEMBL1825061 | 0.41 | IDH1 (0.30) | — | |
| SCHEMBL1199564 | 0.40 | — | — | |
| SCHEMBL247869 | 0.39 | — | — | |
| SCHEMBL1392535 | 0.37 | P2RX7 (0.33) | — | |
| SCHEMBL11572133 | 0.37 | IDH1 (0.32) | — | |
| SCHEMBL1599923 | 0.35 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1912648-A2 | QUINOLINE DERIVATIVES AS ANTIBACTERIAL AGENTS | JANSSEN PHARMACEUTICA N.V. (BE) | 2008-04-23 | — | — | EP | disclosed |
| WO-2007014941-A2 | QUINOLINE DERIVATIVES AS ANTIBACTERIAL AGENTS | JANSSEN PHARMACEUTICA N.V. (BE) | 2007-02-08 | — | — | WO | disclosed |
| EP-1713776-A1 | QUINOLINE DERIVATIVES FOR USE AS MYCOBACTERIAL INHIBITORS | JANSSEN PHARMACEUTICA N.V. (BE) | 2006-10-25 | — | — | EP | disclosed |
| WO-2005075428-A1 | QUINOLINE DERIVATIVES FOR USE AS MYCOBACTERIAL INHIBITORS | JANSSEN PHARMACEUTICA N.V. (BE) | 2005-08-18 | — | — | WO | disclosed |