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 | |
|---|---|---|---|---|
| Monoethanolamine SCHEMBL629131 | 0.87 | ALDH1A1 (0.47) | ALDH1A1TSHR | |
| Phosphonic Acid SCHEMBL9718350 | 0.84 | TSHR (0.41) | ALDH1A1TSHR | |
| Ethylenediamine SCHEMBL29282548 | 0.81 | — | — | |
| Ethylene Glycol SCHEMBL11777839 | 0.78 | TSHR (0.36) | TSHR | |
| SCHEMBL29089625 | 0.78 | CA12 (0.42) | ALDH1A1TSHR | |
| Phosphonic Acid SCHEMBL6897152 | 0.76 | NFKB1 (0.41) | ALDH1A1TSHR | |
| Butyl Alcohol SCHEMBL10389144 | 0.75 | ALDH1A1 (0.55) | ALDH1A1TSHR | |
| Dodecylamine SCHEMBL28686744 | 0.75 | DNM1 (0.56) | ALDH1A1TSHR | |
| SCHEMBL17028873 | 0.74 | TSHR (0.58) | ALDH1A1TSHR | |
| SCHEMBL16933 | 0.74 | — | — |
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-0401243-B1 | MEDICINAL PREPARATIONS CHARACTERIZED BY A COMBINATION OF CYTOSTATIC AGENTS, HORMONAL THERAPEUTIC AGENTS AND PHOSPHONE DERIVATIVES | Henkel Kommanditgesellschaft auf Aktien (DE) | 1992-09-02 | — | — | EP | claimed |