⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30130696 | 0.80 | — | — | |
| SCHEMBL19821916 | 0.79 | MTNR1A (0.37) | — | |
| SCHEMBL13130750 | 0.78 | ALDH1A1 (0.36) | — | |
| SCHEMBL855074 | 0.78 | TGFBR1 (0.37) | — | |
| SCHEMBL30208805 | 0.78 | CRBN (0.36) | — | |
| SCHEMBL13130767 | 0.76 | TSHR (0.39) | — | |
| SCHEMBL5981227 | 0.76 | EPHX2 (0.47) | — | |
| SCHEMBL19787853 | 0.76 | KDM4E (0.32) | — | |
| SCHEMBL26770642 | 0.75 | MEN1 (0.41) | — | |
| SCHEMBL20842419 | 0.75 | TSHR (0.42) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010143071-A2 | CARBAMOYL TRIAZOLINONE BASED HERBICIDE COMBINATIONS AND METHODS OF USE | ARYSTA LIFESCIENCE CORPORATION (JP) | 2010-12-16 | — | — | WO | claimed |
| EP-3876731-A1 | COMPOSITIONS COMPRISING PYRIDINE CARBOXYLATE HERBICIDES AND VERY LONG CHAIN FATTY ACID (VLCFA) SYNTHESIS INHIBITOR HERBICIDES | Corteva Agriscience LLC (US) | 2021-09-15 | — | — | EP | disclosed |
| EP-2317855-A2 | HERBICIDAL COMBINATION COMPRISING DIMETHOXY-TRIAZINYL-SUBSTITUTED DIFLUOROMETHANE SULFONYLANILIDES | BAYER CROPSCIENCE AG (DE) | 2011-05-11 | — | — | EP | disclosed |