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 | |
|---|---|---|---|---|
| SCHEMBL18650454 | 0.92 | — | — | |
| SCHEMBL18650262 | 0.78 | — | — | |
| SCHEMBL6854231 | 0.69 | — | — | |
| SCHEMBL532209 | 0.65 | — | — | |
| SCHEMBL18650460 | 0.65 | — | — | |
| SCHEMBL34472535 | 0.62 | — | — | |
| SCHEMBL641966 | 0.61 | ALDH1A1 (0.37) | ALDH1A1 | |
| SCHEMBL1681773 | 0.61 | ALDH1A1 (0.37) | ALDH1A1 | |
| SCHEMBL1539174 | 0.61 | ALDH1A1 (0.37) | ALDH1A1 | |
| SCHEMBL8732941 | 0.58 | ALDH1A1 (0.42) | ALDH1A1 |
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-2017045648-A1 | PREPARATION METHOD FOR DEUTERATED COMPOUND | 正大天晴药业集团股份有限公司 | 2017-03-23 | — | — | WO | disclosed |