⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7878899 | 0.81 | — | — | |
| SCHEMBL18386520 | 0.79 | — | — | |
| SCHEMBL15919012 | 0.76 | — | — | |
| SCHEMBL12812138 | 0.73 | — | — | |
| SCHEMBL22001191 | 0.72 | — | — | |
| SCHEMBL22416875 | 0.72 | TDP1 (0.32) | — | |
| SCHEMBL22314092 | 0.72 | — | — | |
| SCHEMBL16127205 | 0.70 | — | — | |
| SCHEMBL10465706 | 0.70 | — | — | |
| SCHEMBL18902734 | 0.68 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2258366-A2 | Quinoline derivatives and quinazoline derivatives capable of inhibiting autophosphorylation of hepatocyte growth factor receptors, and pharmaceutical composition comprising the same | Kirin Pharma Kabushiki Kaisha (JP) | 2010-12-08 | — | — | EP | disclosed |