⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21047605 | 0.85 | EPHX2 (0.36) | — | |
| SCHEMBL8299385 | 0.69 | NISCH (0.38) | — | |
| SCHEMBL28392894 | 0.67 | — | — | |
| SCHEMBL211121 | 0.67 | — | — | |
| SCHEMBL18469868 | 0.67 | — | — | |
| SCHEMBL2083052 | 0.67 | — | — | |
| SCHEMBL211122 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL243026 | 0.65 | — | — | |
| SCHEMBL2369431 | 0.63 | MAPK1 (0.41) | — | |
| SCHEMBL14864599 | 0.63 | MAPK1 (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-103476256-B | SDHI fungicide is used for the stem canker resistance of ASR tolerance and/or the purposes of frogeye leaf spot resistant soybean kind of conventional breeding | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2016-01-20 | — | — | CN | disclosed |
| CN-104602520-A | Compositions comprising a pesticidal terpene mixture and an insecticide | BAYER CROPSCIENCE AG | 2015-05-06 | — | — | CN | disclosed |
| CN-104470359-A | Compositiions comprising a biological control agent and an insecticide | BAYER CROPSCIENCE AG | 2015-03-25 | — | — | CN | disclosed |
| CN-104302179-A | Use of host defense inducers for controlling bacterial harmful organisms in useful plants | BAYER IP GMBH | 2015-01-21 | — | — | CN | disclosed |