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 | |
|---|---|---|---|---|
| SCHEMBL9861825 | 1.00 | CYP3A4 (0.32) | CYP3A4TDP1 | |
| SCHEMBL4974734 | 0.79 | CYP3A4 (0.35) | CYP3A4TDP1 | |
| SCHEMBL6408532 | 0.79 | CYP3A4 (0.35) | CYP3A4TDP1 | |
| SCHEMBL1128820 | 0.79 | CYP3A4 (0.35) | CYP3A4TDP1 | |
| SCHEMBL4974727 | 0.79 | CYP3A4 (0.35) | CYP3A4TDP1 | |
| SCHEMBL15527382 | 0.78 | CYP3A4 (0.33) | CYP3A4TDP1 | |
| SCHEMBL15527648 | 0.74 | CYP1A2 (0.37) | CYP3A4 | |
| SCHEMBL14819091 | 0.72 | CYP3A4 (0.36) | CYP3A4TDP1 | |
| SCHEMBL1652690 | 0.72 | CYP3A4 (0.36) | CYP3A4TDP1 | |
| SCHEMBL1652688 | 0.72 | CYP3A4 (0.36) | CYP3A4TDP1 |
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-0273489-B1 | PROCESS FOR THE SELECTIVE PREPARATION OF ALKENECARBOXYLIC ACID DERIVATIVES | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1991-07-24 | — | — | EP | claimed |