SCHEMBL17864141

SCHEMBL17864141

COc1cnc(OCI)n2nc(NS(=O)(=O)c3c(OCC(F)F)cccc3C(F)(F)F)nc12

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 4/20 0.34
PSEN1 P49768 1/20 0.33
PSEN2 P49810 1/20 0.33
KCNH2 Q12809 1/20 0.33
APH1B Q8WW43 1/20 0.33
NCSTN Q92542 1/20 0.33
APH1A Q96BI3 1/20 0.33
PSENEN Q9NZ42 1/20 0.33
PI4KB Q9UBF8 1/20 0.33
SLC22A12 Q96S37 4/20 0.33
CCR4 P51679 1/20 0.32
MAPK10 P53779 1/20 0.31
SCN9A Q15858 1/20 0.31
APLNR P35414 4/20 0.31
CYP1A2 P05177 2/20 0.31
CYP3A4 P08684 2/20 0.31
CYP2D6 P10635 2/20 0.31
TSHR P16473 2/20 0.31
CYP2C19 P33261 2/20 0.31
CYP2C9 P11712 1/20 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
Penoxsulam SCHEMBL116968 0.93 PSEN1 (0.35) EDNRAPSEN1PSEN2KCNH2APH1B
Penoxsulam SCHEMBL22587372 0.93 PSEN1 (0.34) EDNRAPSEN1PSEN2KCNH2APH1B
SCHEMBL18289965 0.88 SLC22A12 (0.34) EDNRAPSEN1PSEN2KCNH2APH1B
SCHEMBL17864073 0.88 SLC22A12 (0.34) SLC22A12CCR4MAPK10SCN9AAPLNR
Penoxsulam SCHEMBL20723756 0.84 PTK2 (0.33) EDNRACCR4MAPK10HSD17B10ALDH1A1
SCHEMBL15449646 0.83 EDNRA (0.35) EDNRAPSEN1PSEN2KCNH2APH1B
Penoxsulam SCHEMBL12472642 0.82 PDCD1 (0.31) MAPK10
SCHEMBL7865966 0.82 SLC22A12 (0.34) SLC22A12CCR4MAPK10SCN9AAPLNR
SCHEMBL7864634 0.82 SLC22A12 (0.37) SLC22A12CCR4MAPK10SCN9ACYP1A2
Penoxsulam SCHEMBL2373895 0.82 EGFR (0.33) PSEN1PSEN2KCNH2APH1BNCSTN

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016099802-A1 SYNERGISTIC HERBICIDAL COMPOSITION CONTAINING PENOXSULAM, TRICLOPYR AND BISPYRIBAC DOW AGROSCIENCES LLC (US) 2016-06-23 WO disclosed