Tembotrione

Tembotrione

SCHEMBL169933

CS(=O)(=O)c1ccc(C(=O)C2C(=O)CCCC2=O)c(Cl)c1COCC(F)(F)F.CS(=O)(=O)c1ccc(C(=O)C2C(=O)CCCC2=O)c(Cl)c1COCC1CCCO1

nearest known ligand 0.79

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.40
ADRB2 P07550 1/20 0.40
MAPK1 P28482 2/20 0.37
ALDH1A1 P00352 1/20 0.37
SCN9A Q15858 1/20 0.33
OXTR P30559 1/20 0.33
CNR2 P34972 1/20 0.33
TSHR P16473 1/20 0.33
SCN10A Q9Y5Y9 1/20 0.32
P2RX7 Q99572 1/20 0.32
HPGD P15428 1/20 0.32
RORC P51449 1/20 0.32
PDE2A O00408 1/20 0.31
HPD P32754 1/20 0.31
THRB P10828 1/20 0.31
PSEN1 P49768 2/20 0.31
PSEN2 P49810 2/20 0.31
APH1B Q8WW43 2/20 0.31
NCSTN Q92542 2/20 0.31
APH1A Q96BI3 2/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL118936 0.93 OXTR (0.36) KDM4EADRB2MAPK1ALDH1A1SCN9A
SCHEMBL12770865 0.91 OXTR (0.34) KDM4EADRB2SCN9AOXTRTHRB
Tembotrione SCHEMBL116424 0.89 HPD (0.38) ALDH1A1HPD
Tembotrione SCHEMBL29352862 0.89 HPD (0.38) ALDH1A1HPD
Tembotrione SCHEMBL3225813 0.89 HPD (0.38) ALDH1A1HPD
Tembotrione SCHEMBL20723452 0.88 HPD (0.37) ALDH1A1HPD
Tembotrione SCHEMBL20723428 0.88 HPD (0.37) ALDH1A1HPD
SCHEMBL1965392 0.86 KDM4E (0.35) KDM4EADRB2MAPK1ALDH1A1SCN9A
SCHEMBL3761547 0.84 KDM4E (0.33) KDM4EADRB2MAPK1ALDH1A1CNR2
Tembotrione SCHEMBL170587 0.84 KDM4E (0.32) KDM4EADRB2MAPK1ALDH1A1

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022012320-A1 COMPOUND, HERBICIDAL COMPOSITION, AND APPLICATION THEREOF 周银平 2022-01-20 WO disclosed
CN-107428777-A QUINOLINE COMPOUNDS 巴斯夫欧洲公司 2017-12-01 CN disclosed
EP-3244742-A1 HERBICIDAL COMBINATION COMPRISING SAFLUFENACIL AND GLUFOSINATE BASF SE (DE) 2017-11-22 EP disclosed
WO-2016113334-A1 HERBICIDAL COMBINATION COMPRISING SAFLUFENACIL AND GLUFOSINATE BASF SE (DE) 2016-07-21 WO disclosed
US-8673814-B2 Synergistic combinations which are compatible with cultivated plants and which comprise herbicides selected from the group consisting of benzoylcyclohexanediones for use in rice crops BAYER CROPSCIENCE AG (DE) 2014-03-18 US disclosed
CN-101686671-B Synergistic crop-tolerated combinations of herbicides from the benzoylcyclohexandione group for application in rice growing BAYER CROPSCIENCE AG 2013-10-02 CN disclosed
US-20120058894-A1 SYNERGISTIC COMBINATIONS WHICH ARE COMPATIBLE WITH CULTIVATED PLANTS AND WHICH COMPRISE HERBICIDES SELECTED FROM THE GROUP CONSISTING OF BENZOYLCYCLOHEXANEDIONES FOR USE IN RICE CROPS BAYER CROPSCIENCE AG (DE) 2012-03-08 US disclosed
CN-101686671-A Synergistic crop-tolerated combinations of herbicides from the benzoylcyclohexandione group for application in rice growing BAYER CROPSCIENCE AG 2010-03-31 CN disclosed
US-20080318786-A1 SYNERGISTIC COMBINATIONS WHICH ARE COMPATIBLE WITH CULTIVATED PLANTS AND WHICH COMPRISE HERBICIDES SELECTED FROM THE GROUP CONSISTING OF BENZOYLCYCLOHEXANEDIONES FOR USE IN RICE CROPS BAYER CROPSCIENCE AG (DE) 2008-12-25 US disclosed