SCHEMBL27946207

SCHEMBL27946207

COc1cc(NC(=O)NS(=O)(=O)c2ncccc2OCC(F)(F)F)nc(OC)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.40
FBP1 P09467 5/20 0.38
CREBBP Q92793 1/20 0.38
SLC40A1 Q9NP59 1/20 0.36
S1PR1 P21453 1/20 0.35
MAPT P10636 2/20 0.35
MEN1 O00255 1/20 0.35
S1PR2 O95136 1/20 0.35
S1PR4 O95977 1/20 0.35
LMNA P02545 1/20 0.35
XBP1 P17861 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
PAX8 Q06710 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
S1PR3 Q99500 1/20 0.35
S1PR5 Q9H228 1/20 0.35
EGLN1 Q9GZT9 1/20 0.35
PLK4 O00444 1/20 0.35

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
SCHEMBL7760051 0.87 GAA (0.41) GAAFBP1CREBBPSLC40A1PLK4
Trifloxysulfuron SCHEMBL15449154 0.87 GAA (0.55) GAAS1PR1MAPTMEN1HTT
Trifloxysulfuron SCHEMBL64184 0.87 GAA (0.55) GAAS1PR1MAPTMEN1HTT
SCHEMBL27392302 0.86 GAA (0.39) GAAFBP1CREBBPSLC40A1MAPT
Trifloxysulfuron SCHEMBL301007 0.86 GAA (0.54) GAAS1PR1MAPTMEN1HTT
Trifloxysulfuron SCHEMBL14768215 0.85 GAA (0.53) GAAS1PR1MAPTLMNAXBP1
SCHEMBL27303738 0.85 GAA (0.41) GAAFBP1CREBBPSLC40A1MAPT
SCHEMBL10875764 0.83 GAA (0.40) GAAFBP1CREBBPSLC40A1MEN1
SCHEMBL10875769 0.83 GAA (0.40) GAAFBP1CREBBPSLC40A1MEN1
SCHEMBL27351851 0.82 GAA (0.40) GAAFBP1CREBBPSLC40A1MAPT

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102711453-B Stable oil-in-water emulsions DOW AGROSCIENCES LLC 2014-07-16 CN claimed
CN-102711453-B Stable oil-in-water emulsions DOW AGROSCIENCES LLC 2014-07-16 CN disclosed
CN-101528036-B Herbicidal synergistic composition SYNGENTA PARTICIPATIONS AG 2013-11-20 CN disclosed