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 | |
|---|---|---|---|---|
| SCHEMBL15695052 | 0.87 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL22736794 | 0.84 | ALDH1A1 (0.39) | ALDH1A1TSHR | |
| SCHEMBL7579549 | 0.79 | ALDH1A1 (0.34) | ALDH1A1TSHR | |
| SCHEMBL7573943 | 0.79 | GSR (0.35) | ALDH1A1TSHR | |
| SCHEMBL7573462 | 0.77 | ALDH1A1 (0.38) | ALDH1A1TSHR | |
| SCHEMBL324234 | 0.75 | — | — | |
| SCHEMBL13001164 | 0.74 | — | — | |
| SCHEMBL13000794 | 0.74 | — | — | |
| SCHEMBL9951425 | 0.74 | ALDH1A1 (0.42) | ALDH1A1TSHR | |
| SCHEMBL2014461 | 0.73 | CPA1 (0.35) | 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 |
|---|---|---|---|---|---|---|---|
| US-4561862-A | Use of selected beta-nitroalkenes as cetane number boosters for diesel fuel | OLIN CORPORATION (US) | 1985-12-31 | — | — | US | disclosed |