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 | |
|---|---|---|---|---|
| Cyclohexane SCHEMBL6254769 | 0.81 | ALDH1A1 (0.33) | — | |
| SCHEMBL2855180 | 0.76 | ALDH1A1 (0.36) | — | |
| Methane SCHEMBL6250798 | 0.74 | ALDH1A1 (0.35) | — | |
| SCHEMBL3389888 | 0.73 | GBA1 (0.33) | TP53CYP3A4 | |
| Ethane SCHEMBL6251968 | 0.72 | ALDH1A1 (0.36) | — | |
| SCHEMBL29077791 | 0.71 | — | — | |
| Benzene SCHEMBL8847070 | 0.70 | TDP1 (0.39) | TP53CYP3A4 | |
| SCHEMBL10801123 | 0.69 | ALDH1A1 (0.31) | — | |
| SCHEMBL6252497 | 0.69 | — | — | |
| SCHEMBL1611850 | 0.68 | — | — |
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-1306370-B1 | Dithiocarbamates containing alkylthio and hydroxy substituents | AFTON CHEMICAL INTANGIBLES LLC (US) | 2005-09-07 | — | — | EP | claimed |
| EP-0166695-A2 | Process for the preparation of glycidyl thioethers | CIBA-GEIGY AG (CH) | 1986-01-02 | — | — | EP | disclosed |