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 | |
|---|---|---|---|---|
| SCHEMBL24017041 | 1.00 | TSHR (0.35) | TSHRALDH1A1 | |
| SCHEMBL11141051 | 0.83 | — | — | |
| SCHEMBL24017016 | 0.81 | TSHR (0.41) | TSHRALDH1A1 | |
| SCHEMBL24017013 | 0.81 | TSHR (0.41) | TSHRALDH1A1 | |
| SCHEMBL1243017 | 0.80 | TSHR (0.35) | TSHRALDH1A1 | |
| SCHEMBL1205871 | 0.80 | — | — | |
| SCHEMBL9350318 | 0.78 | — | — | |
| SCHEMBL462497 | 0.75 | — | — | |
| SCHEMBL20679746 | 0.75 | — | — | |
| SCHEMBL18752930 | 0.75 | — | — |
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-2021223156-A1 | DIBORON GLYCOL ESTER, PREPARATION METHOD THEREFOR, INTERMEDIATE THEREOF, AND APPLICATION THEREOF | 中国科学院上海有机化学研究所 | 2021-11-11 | — | — | WO | disclosed |