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 | |
|---|---|---|---|---|
| SCHEMBL5070400 | 0.70 | MEN1 (0.30) | — | |
| SCHEMBL5092852 | 0.68 | ALDH1A1 (0.38) | ALDH1A1 | |
| SCHEMBL16796442 | 0.64 | ALDH1A1 (0.38) | ALDH1A1TDP1 | |
| SCHEMBL305550 | 0.64 | — | — | |
| Iodide SCHEMBL22034509 | 0.62 | — | — | |
| Propionitrile SCHEMBL27986366 | 0.61 | — | — | |
| Ammonia Solution, Strong SCHEMBL28252583 | 0.58 | — | — | |
| Ammonia Solution, Strong SCHEMBL995681 | 0.55 | — | — | |
| Ammonia Solution, Strong SCHEMBL27300464 | 0.55 | — | — | |
| SCHEMBL56391 | 0.51 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0109406-A1 | METHOD FOR THE PREPARATION OF AMINO-CETONITRILES | CEMONA AG (CH) | 1984-05-30 | — | — | EP | disclosed |
| WO-1983004020-A1 | METHOD FOR THE PREPARATION OF AMINO-CETONITRILES | CEMONA AG (CH) | 1983-11-24 | — | — | WO | disclosed |