⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL323519 | 0.78 | — | — | |
| SCHEMBL18632175 | 0.75 | — | — | |
| SCHEMBL4063907 | 0.75 | — | — | |
| SCHEMBL477607 | 0.73 | — | — | |
| SCHEMBL1316401 | 0.73 | — | — | |
| SCHEMBL2036521 | 0.73 | — | — | |
| SCHEMBL620238 | 0.73 | — | — | |
| SCHEMBL19411969 | 0.72 | — | — | |
| SCHEMBL71027 | 0.71 | — | — | |
| SCHEMBL201975 | 0.71 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1943244-A1 | PYRAZOLE-ISOQUINOLINE UREA DERIVATIVES AS P38 KINASE INHIBITORS | ELI LILLY AND COMPANY (US) | 2008-07-16 | — | — | EP | claimed |
| WO-2007053346-A1 | PYRAZOLE-ISOQUINOLINE UREA DERIVATIVES AS P38 KINASE INHIBITORS | ELI LILLY AND COMPANY (US) | 2007-05-10 | — | — | WO | claimed |
| WO-2020120284-A1 | PREPARATION OF 6-HALO-2-(HALOALKYL)-3-ACYLPYRIDINES AND INTERMEDIATES THEREFOR | BAYER AKTIENGESELLSCHAFT (DE) | 2020-06-18 | — | — | WO | disclosed |
| EP-3201188-A1 | NOVEL TRIAZOLE DERIVATIVES USEFUL AS FUNGICIDES | Bayer CropScience Aktiengesellschaft (DE) | 2017-08-09 | — | — | EP | disclosed |
| WO-2016050769-A1 | NOVEL TRIAZOLE DERIVATIVES USEFUL AS FUNGICIDES | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2016-04-07 | — | — | WO | disclosed |
| EP-2984082-A1 | NOVEL TRIAZOLE DERIVATIVES | Bayer CropScience Aktiengesellschaft (DE) | 2016-02-17 | — | — | EP | disclosed |
| WO-2014167010-A1 | NOVEL TRIAZOLE DERIVATIVES | BAYER CROPSCIENCE AG (DE) | 2014-10-16 | — | — | WO | disclosed |
| EP-1943244-A1 | PYRAZOLE-ISOQUINOLINE UREA DERIVATIVES AS P38 KINASE INHIBITORS | ELI LILLY AND COMPANY (US) | 2008-07-16 | — | — | EP | disclosed |
| WO-2007053346-A1 | PYRAZOLE-ISOQUINOLINE UREA DERIVATIVES AS P38 KINASE INHIBITORS | ELI LILLY AND COMPANY (US) | 2007-05-10 | — | — | WO | disclosed |