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 | |
|---|---|---|---|---|
| SCHEMBL5017135 | 0.79 | CSNK2A1 (0.40) | CHEK1 | |
| SCHEMBL5015726 | 0.78 | GPR35 (0.31) | — | |
| SCHEMBL5024323 | 0.77 | CHEK1 (0.48) | CHEK1 | |
| SCHEMBL5017095 | 0.75 | CHEK1 (0.41) | CHEK1MCL1 | |
| SCHEMBL5015632 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL5015643 | 0.71 | — | — | |
| SCHEMBL5015729 | 0.71 | AKR1B1 (0.34) | — | |
| SCHEMBL5017759 | 0.69 | MAOB (0.37) | — | |
| SCHEMBL5024199 | 0.69 | — | — | |
| SCHEMBL5015633 | 0.69 | CHEK1 (0.33) | CHEK1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1904449-A2 | INHIBITORS OF CHECKPOINT KINASES | Merck & Co., Inc. (US) | 2008-04-02 | — | — | EP | claimed |
| WO-2007008502-A2 | INHIBITORS OF CHECKPOINT KINASES | MERCK & CO., INC. (US) | 2007-01-18 | — | — | WO | claimed |
| EP-1904449-A2 | INHIBITORS OF CHECKPOINT KINASES | Merck & Co., Inc. (US) | 2008-04-02 | — | — | EP | disclosed |
| WO-2007008502-A2 | INHIBITORS OF CHECKPOINT KINASES | MERCK & CO., INC. (US) | 2007-01-18 | — | — | WO | disclosed |