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 | |
|---|---|---|---|---|
| SCHEMBL14068299 | 0.89 | ALDH1A1 (0.30) | ALDH1A1CYP2D6 | |
| SCHEMBL13110779 | 0.83 | ALDH1A1 (0.31) | ALDH1A1CYP2D6 | |
| SCHEMBL17993850 | 0.83 | ALDH1A1 (0.33) | ALDH1A1CYP2D6 | |
| SCHEMBL13110768 | 0.83 | ALDH1A1 (0.31) | ALDH1A1CYP2D6 | |
| SCHEMBL13110777 | 0.82 | ALDH1A1 (0.30) | ALDH1A1CYP2D6 | |
| SCHEMBL13110773 | 0.81 | ALDH1A1 (0.34) | ALDH1A1CYP2D6 | |
| SCHEMBL13979435 | 0.80 | — | — | |
| SCHEMBL13110830 | 0.78 | — | — | |
| SCHEMBL13110726 | 0.74 | CYP1A2 (0.37) | ALDH1A1 | |
| SCHEMBL13110754 | 0.74 | PIN1 (0.36) | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7820831-B2 | Compounds comprising a thiocarbonyl-sulfanyl group which can be used for the radical synthesis of α-perfluoroalkylamine compounds | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) | 2010-10-26 | — | — | US | disclosed |
| US-7820831-B2 | Compounds comprising a thiocarbonyl-sulfanyl group which can be used for the radical synthesis of α-perfluoroalkylamine compounds | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) | 2010-10-26 | — | — | US | disclosed |
| US-7423161-B2 | Compounds comprising a thiocarbonyl-sulfanyl group, which can be used for the radical synthesis of-α-perfluoroalkylamines | RHODIA CHIMIE (FR) | 2008-09-09 | — | — | US | disclosed |