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 | |
|---|---|---|---|---|
| SCHEMBL28222420 | 0.89 | — | — | |
| SCHEMBL26673240 | 0.80 | SRD5A1 (0.38) | SRD5A1 | |
| SCHEMBL3944528 | 0.79 | SRD5A1 (0.35) | SRD5A1 | |
| SCHEMBL3944336 | 0.79 | SRD5A1 (0.35) | SRD5A1 | |
| SCHEMBL9998683 | 0.78 | SRD5A1 (0.37) | SRD5A1 | |
| SCHEMBL18150856 | 0.78 | SRD5A1 (0.37) | SRD5A1 | |
| SCHEMBL18289470 | 0.77 | SRD5A1 (0.43) | SRD5A1GAA | |
| SCHEMBL12534015 | 0.76 | SRD5A1 (0.38) | SRD5A1 | |
| SCHEMBL18151596 | 0.75 | SRD5A1 (0.35) | SRD5A1GAA | |
| SCHEMBL5567030 | 0.74 | ALDH1A1 (0.36) | SRD5A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016128140-A1 | PYRIMIDINE DERIVATIVES FOR USE IN THE TREATMENT OF CANCER | MERCK PATENT GMBH (DE) | 2016-08-18 | — | — | WO | disclosed |