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 | |
|---|---|---|---|---|
| SCHEMBL14763639 | 0.77 | MKNK1 (0.40) | — | |
| SCHEMBL1550425 | 0.76 | PPARA (0.33) | — | |
| SCHEMBL14764550 | 0.75 | KDM5A (0.38) | ELANE | |
| SCHEMBL671541 | 0.73 | ROCK2 (0.45) | ELANENR1H2 | |
| SCHEMBL14809472 | 0.73 | MEN1 (0.34) | — | |
| SCHEMBL14764140 | 0.73 | KDM5A (0.41) | ELANE | |
| SCHEMBL16424171 | 0.72 | DGAT1 (0.32) | NR1H2 | |
| SCHEMBL14764015 | 0.71 | KDM5A (0.44) | ELANE | |
| SCHEMBL16553920 | 0.70 | ALDH1A1 (0.40) | — | |
| SCHEMBL14764292 | 0.70 | P2RX7 (0.33) | ELANE |
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-2753615-B1 | BENZONITRILE DERIVATIVES AS KINASE INHIBITORS | MERCK PATENT GMBH (DE) | 2017-07-19 | — | — | EP | disclosed |
| WO-2013034238-A1 | BENZONITRILE DERIVATIVES AS KINASE INHIBITORS | MERCK PATENT GMBH (DE) | 2013-03-14 | — | — | WO | disclosed |