⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| SCHEMBL9959669 | 0.64 | — | — | |
| SCHEMBL9960025 | 0.62 | — | — | |
| SCHEMBL9959710 | 0.62 | KDM4E (0.38) | — | |
| SCHEMBL15294473 | 0.61 | HPGD (0.42) | — | |
| SCHEMBL15294474 | 0.61 | — | — | |
| SCHEMBL2731757 | 0.61 | FGFR1 (0.40) | — | |
| SCHEMBL29989125 | 0.61 | CYP4F2 (0.41) | — | |
| SCHEMBL15248177 | 0.60 | MAPK1 (0.43) | — | |
| SCHEMBL17948434 | 0.60 | TEAD1 (0.37) | — | |
| SCHEMBL15294471 | 0.60 | JMJD6 (0.46) | — |
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-2654748-A1 | INDAZOLE DERIVATIVES USEFUL AS ERK INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2013-10-30 | — | — | EP | disclosed |
| WO-2012087772-A1 | INDAZOLE DERIVATIVES USEFUL AS ERK INHIBITORS | SCHERING CORPORATION (US) | 2012-06-28 | — | — | WO | disclosed |