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 | |
|---|---|---|---|---|
| SCHEMBL3936190 | 0.89 | SLC6A4 (0.31) | SLC6A4TDP1 | |
| SCHEMBL19969956 | 0.81 | SLC6A4 (0.33) | SLC6A4 | |
| SCHEMBL19068174 | 0.81 | SLC6A4 (0.38) | SLC6A4TDP1 | |
| SCHEMBL172690 | 0.81 | SLC6A4 (0.38) | SLC6A4TDP1 | |
| SCHEMBL11803801 | 0.80 | TSHR (0.35) | TDP1 | |
| SCHEMBL104880 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL22575324 | 0.77 | TDP1 (0.44) | SLC6A4TDP1 | |
| SCHEMBL21277057 | 0.77 | SLC6A4 (0.36) | SLC6A4TDP1 | |
| SCHEMBL23846184 | 0.77 | TSHR (0.32) | SLC6A4 | |
| SCHEMBL24930782 | 0.76 | SLC6A4 (0.32) | SLC6A4 |
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-2023028536-A1 | 1,2,4-TRIAZINE DERIVATIVES USEFUL AS INHIBITORS OF NLRP3 | PTC THERAPEUTICS, INC. (US) | 2023-03-02 | — | — | WO | disclosed |