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 | |
|---|---|---|---|---|
| SCHEMBL20835006 | 0.84 | FFAR1 (0.32) | FFAR1FFAR4 | |
| SCHEMBL24940712 | 0.83 | USP2 (0.30) | — | |
| SCHEMBL24940737 | 0.82 | ALDH1A1 (0.30) | — | |
| SCHEMBL20834934 | 0.81 | GRM5 (0.38) | FFAR1FFAR4 | |
| SCHEMBL24940631 | 0.78 | CYP11B1 (0.39) | FFAR1FFAR4 | |
| SCHEMBL23395480 | 0.78 | RAPGEF4 (0.30) | — | |
| SCHEMBL21399529 | 0.78 | ALDH1A1 (0.39) | FFAR1FFAR4 | |
| SCHEMBL19465072 | 0.78 | ALDH1A1 (0.39) | FFAR1FFAR4 | |
| SCHEMBL20834691 | 0.77 | — | — | |
| SCHEMBL21675422 | 0.76 | GRM5 (0.42) | FFAR1FFAR4 |
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-3681976-B1 | ISOTHIOCYANATO TOLANE DERIVATIVES | MERCK PATENT GMBH (DE) | 2021-05-26 | — | — | EP | disclosed |
| WO-2019052972-A1 | ISOTHIOCYANATO TOLANE DERIVATIVES | MERCK PATENT GMBH (DE) | 2019-03-21 | — | — | WO | disclosed |