SCHEMBL7822266

SCHEMBL7822266

Cc1ccc(S(=O)(=O)N(CCC(=O)O)c2ccc(F)cc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 3/20 0.65
NFE2L2 Q16236 3/20 0.65
SMN1; SMN2 Q16637 3/20 0.56
CNR1 P21554 1/20 0.56
CNR2 P34972 1/20 0.56
RORC P51449 3/20 0.56
KMT2A Q03164 3/20 0.55
TSHR P16473 1/20 0.54
MAPK1 P28482 1/20 0.54
HSD17B10 Q99714 1/20 0.54
PPARG P37231 1/20 0.53
POLB P06746 2/20 0.53
MEN1 O00255 1/20 0.53
HTT P42858 2/20 0.53
KDM4E B2RXH2 1/20 0.53
ALDH1A1 P00352 1/20 0.53
LMNA P02545 2/20 0.52
TAS2R14 Q9NYV8 1/20 0.51
TP53 P04637 1/20 0.51
MAPT P10636 1/20 0.51

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
SCHEMBL14502622 0.87 KEAP1 (0.66) KEAP1NFE2L2CNR1CNR2KMT2A
SCHEMBL2705416 0.86 CNR1 (0.55) KEAP1NFE2L2SMN1; SMN2CNR1CNR2
SCHEMBL6518997 0.86 KEAP1 (0.65) KEAP1NFE2L2CNR1CNR2KMT2A
SCHEMBL7821400 0.84 LMNA (0.72) KEAP1NFE2L2CNR1CNR2KMT2A
SCHEMBL9721821 0.81 CNR1 (0.56) KEAP1NFE2L2SMN1; SMN2CNR1CNR2
SCHEMBL16894157 0.79 KEAP1 (0.71) KEAP1NFE2L2RORCKMT2ATSHR
SCHEMBL2703770 0.78 KEAP1 (0.54) KEAP1NFE2L2CNR1CNR2RORC
SCHEMBL7822866 0.77 LMNA (0.61) KEAP1NFE2L2KMT2AMAPK1PPARG
SCHEMBL2006245 0.77 ESR1 (0.60) KEAP1NFE2L2KMT2ATSHRMAPK1
SCHEMBL13589964 0.77 KEAP1 (0.55) KEAP1NFE2L2SMN1; SMN2CNR2ALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1091958-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2001-04-18 EP disclosed
WO-2000001692-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2000-01-13 WO disclosed