⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13868041 | 0.78 | MEN1 (0.31) | — | |
| SCHEMBL21720441 | 0.74 | ESR1 (0.30) | — | |
| SCHEMBL1106127 | 0.72 | CA2 (0.39) | — | |
| SCHEMBL802210 | 0.72 | PKM (0.38) | — | |
| SCHEMBL13990519 | 0.70 | POLB (0.32) | — | |
| SCHEMBL12731495 | 0.70 | CA2 (0.37) | — | |
| SCHEMBL19807349 | 0.70 | MEN1 (0.31) | — | |
| SCHEMBL803387 | 0.70 | MAPT (0.32) | — | |
| SCHEMBL15113577 | 0.70 | — | — | |
| SCHEMBL20091527 | 0.69 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8324133-B2 | Fungicide 2-pyridyl-methylene-carboxamide derivatives | BAYER CROPSCIENCE AG (DE) | 2012-12-04 | — | — | US | disclosed |
| US-8324133-B2 | Fungicide 2-pyridyl-methylene-carboxamide derivatives | BAYER CROPSCIENCE AG (DE) | 2012-12-04 | — | — | US | disclosed |
| US-20120071517-A1 | 2-PYRIDINYLETHYLCARBOXAMIDE DERIVATIVES AND THEIR USE AS FUNGICIDES | BAYER SAS (FR) | 2012-03-22 | — | — | US | disclosed |
| US-20100010048-A1 | Fungicide 2-pyridyl-methylene-carboxamide derivatives | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2010-01-14 | — | — | US | disclosed |
| US-20100010048-A1 | Fungicide 2-pyridyl-methylene-carboxamide derivatives | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2010-01-14 | — | — | US | disclosed |