SCHEMBL7008210

SCHEMBL7008210

CS(=O)(=O)OCCOc1ccc(OC(F)(F)F)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.46
CHRM5 P08912 2/20 0.40
BCHE P06276 1/20 0.40
ACHE P22303 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
PTGS2 P35354 1/20 0.40
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
FFAR4 Q5NUL3 1/20 0.39
PPARD Q03181 1/20 0.39
PPARA Q07869 1/20 0.39
HRH2 P25021 1/20 0.39
HRH1 P35367 1/20 0.39
ATM Q13315 1/20 0.39
MRGPRX4 Q96LA9 1/20 0.39
MAOB P27338 1/20 0.39
AOC3 Q16853 1/20 0.39
PTPN1 P18031 1/20 0.39
MMP1 P03956 1/20 0.39
MMP2 P08253 1/20 0.39

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
SCHEMBL7007031 0.92 KIF11 (0.45) KIF11CHRM5BCHEACHEL3MBTL1
SCHEMBL7005457 0.86 TRPV1 (0.38) KIF11PTPN1MMP9MMP14MAPT
SCHEMBL7010041 0.84 CHRM5 (0.45) CHRM5L3MBTL1MAOB
SCHEMBL5903752 0.82 BCHE (0.46) KIF11BCHEACHESLC6A4SLC6A3
SCHEMBL11445546 0.81 CYP1A2 (0.50) L3MBTL1MAOBPTPN1ALDH1A1SMN1; SMN2
SCHEMBL16492961 0.80 CA1 (0.33) KIF11CHRM5SLC6A4SLC6A3FFAR4
SCHEMBL6620322 0.80 BCHE (0.44) KIF11BCHEACHESLC6A4SLC6A3
SCHEMBL6276346 0.79 LMNA (0.51) L3MBTL1PTPN1MAPTALDH1A1SMN1; SMN2
SCHEMBL5639227 0.79 BCHE (0.53) BCHEACHEPTGS2FFAR4HRH2
SCHEMBL6277239 0.79 L3MBTL1 (0.49) L3MBTL1ATMPTPN1MAPTALDH1A1

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
EP-0866056-B1 N- (FLUOROALKOXY)PHENOXYALKYL]BENZAMIDE COMPOUNDS, INTERMEDIATES THEREOF, PROCESS FOR PRODUCING THE SAME, AND AGRICULTURAL AND HORTICULTURAL PESTICIDES UBE INDUSTRIES (JP) 2003-01-08 EP disclosed
US-5977410-A N-[(fluoroalkoxy) phenoxyalkyl]benzamide compounds, intermediates thereof, process for producing the same, and agricultural and horticultural pesticides UBE INDUSTRIES, LTD. (JP) 1999-11-02 US disclosed
EP-0866056-A1 N- (FLUOROALKOXY)PHENOXYALKYL]BENZAMIDE COMPOUNDS, INTERMEDIATES THEREOF, PROCESS FOR PRODUCING THE SAME, AND AGRICULTURAL AND HORTICULTURAL PESTICIDES UBE INDUSTRIES, LTD. (JP) 1998-09-23 EP disclosed