Predicted protein targets (top 2)
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL21864801 | 0.83 | AOC3 (0.59) | AOC3 | |
| SCHEMBL21865287 | 0.81 | BRD4 (0.40) | — | |
| SCHEMBL21864799 | 0.80 | AOC3 (0.56) | AOC3AOC2 | |
| SCHEMBL28390714 | 0.78 | AOC3 (0.65) | AOC3AOC2 | |
| SCHEMBL21865003 | 0.73 | AOC3 (0.58) | AOC3AOC2 | |
| SCHEMBL21865286 | 0.71 | HSD17B1 (0.52) | — | |
| SCHEMBL28438097 | 0.69 | AOC3 (0.40) | AOC3 | |
| SCHEMBL21864999 | 0.69 | AOC3 (0.63) | AOC3 | |
| SCHEMBL21865246 | 0.68 | AOC3 (0.64) | AOC3 | |
| SCHEMBL21864988 | 0.67 | AOC3 (0.63) | AOC3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020063854-A1 | QUINOLINE-BASED DERIVATIVES AS VAP-1 INHIBITORS | 南京明德新药研发有限公司 | 2020-04-02 | — | — | WO | disclosed |