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 | |
|---|---|---|---|---|
| SCHEMBL7264382 | 1.00 | ALDH1A1 (0.30) | ALDH1A1TSHR | |
| SCHEMBL10630634 | 0.88 | — | — | |
| SCHEMBL9807093 | 0.88 | — | — | |
| SCHEMBL5970529 | 0.79 | TSHR (0.35) | ALDH1A1TSHR | |
| SCHEMBL11652445 | 0.79 | — | — | |
| SCHEMBL11652446 | 0.79 | — | — | |
| SCHEMBL7700964 | 0.77 | — | — | |
| SCHEMBL7700957 | 0.77 | — | — | |
| SCHEMBL7032953 | 0.75 | — | — | |
| SCHEMBL7032943 | 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-2003051303-A2 | THE TOTAL SYNTHESIS OF MERRILACTONE A | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) | 2003-06-26 | — | — | WO | disclosed |