⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18944097 | 0.82 | — | — | |
| SCHEMBL20122195 | 0.82 | — | — | |
| SCHEMBL27311271 | 0.82 | — | — | |
| SCHEMBL24555486 | 0.81 | — | — | |
| SCHEMBL10331744 | 0.76 | — | — | |
| SCHEMBL20671524 | 0.76 | — | — | |
| SCHEMBL12660837 | 0.76 | — | — | |
| SCHEMBL13838790 | 0.74 | — | — | |
| SCHEMBL18629631 | 0.74 | — | — | |
| SCHEMBL19074160 | 0.70 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20170027174-A1 | Use of 2-chloro-3-(methylsulfanyl)-N-(1-methyl-1H-tetrazol-5-yl)-4-(trifluoromethyl)benzamide or its salts for controlling unwanted plants in areas of transgenic crop plants being tolerant to HPPD inhibitor herbicides | BAYER CROSCIENCE AKTIENGESELLSCHAFT (DE) | 2017-02-02 | — | — | US | disclosed |