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 | |
|---|---|---|---|---|
| SCHEMBL27592700 | 0.79 | — | — | |
| SCHEMBL4608409 | 0.78 | MAPK1 (0.37) | ALDH1A1 | |
| SCHEMBL3605948 | 0.77 | ALDH1A1 (0.33) | ALDH1A1TSHR | |
| SCHEMBL3608833 | 0.77 | ALDH1A1 (0.33) | ALDH1A1TSHR | |
| SCHEMBL3371 | 0.76 | TSHR (0.48) | ALDH1A1TSHR | |
| Water SCHEMBL27821326 | 0.76 | TSHR (0.48) | ALDH1A1TSHR | |
| SCHEMBL28820080 | 0.76 | KCNN4 (0.30) | — | |
| SCHEMBL28929730 | 0.76 | — | — | |
| SCHEMBL11091542 | 0.74 | CYP19A1 (0.37) | ALDH1A1 | |
| Benzene SCHEMBL8005754 | 0.74 | TSHR (0.52) | ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-113727758-A | Bicyclic heterocyclic compounds and use thereof | 锐新医药公司 | 2021-11-30 | — | — | CN | disclosed |