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 | |
|---|---|---|---|---|
| Water SCHEMBL18694754 | 0.82 | ALDH1A1 (0.33) | — | |
| SCHEMBL154866 | 0.82 | ALDH1A1 (0.33) | — | |
| SCHEMBL29349966 | 0.82 | ALDH1A1 (0.33) | — | |
| SCHEMBL923735 | 0.80 | — | — | |
| SCHEMBL8942424 | 0.77 | — | — | |
| SCHEMBL21627337 | 0.76 | TSHR (0.32) | — | |
| SCHEMBL2048406 | 0.75 | MCL1 (0.33) | — | |
| SCHEMBL23129 | 0.75 | — | — | |
| SCHEMBL11134471 | 0.73 | MEN1 (0.35) | MEN1KMT2A | |
| SCHEMBL28844645 | 0.70 | TSHR (0.52) | MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1391430-A1 | Synergistic biocidal mixtures | HERCULES INCORPORATED (US) | 2004-02-25 | — | — | EP | disclosed |