⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL500207 | 0.68 | — | — | |
| SCHEMBL2670420 | 0.67 | — | — | |
| SCHEMBL2670131 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL2434044 | 0.66 | — | — | |
| SCHEMBL2670167 | 0.65 | — | — | |
| SCHEMBL12453126 | 0.64 | — | — | |
| Hydrochloric Acid SCHEMBL21879698 | 0.61 | KDM4E (0.31) | — | |
| SCHEMBL16874281 | 0.61 | KDM4E (0.31) | — | |
| Hydrochloric Acid SCHEMBL1936903 | 0.60 | KDM4E (0.30) | — | |
| SCHEMBL15160440 | 0.58 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20080139574-A1 | Novel quinoline derivatives | CADILA HEALTHCARE LIMITED | 2008-06-12 | — | — | US | disclosed |
| EP-1927589-A1 | Quinoline derivatives | CADILA HEALTHCARE LTD. (IN) | 2008-06-04 | — | — | EP | disclosed |