SCHEMBL7083749

SCHEMBL7083749

Cc1ccc(S(=O)(=O)OCCc2csc(NCC(=O)OC(C)(C)C)n2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 4/20 0.40
DDR2 Q16832 2/20 0.39
MAPK13 O15264 1/20 0.39
MAPK12 P53778 1/20 0.39
DDR1 Q08345 1/20 0.39
MAPK11 Q15759 1/20 0.39
ALDH1A1 P00352 4/20 0.39
MAPT P10636 3/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
KMT2A Q03164 4/20 0.37
MEN1 O00255 3/20 0.37
PKM P14618 1/20 0.37
PSMD10 O75832 1/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
GAA P10253 1/20 0.36

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
SCHEMBL6800933 0.87 SIRT1 (0.44) MAPK14DDR2MAPK13MAPK12DDR1
SCHEMBL6794653 0.77 PSMD10 (0.35) MAPK14ALDH1A1MAPTLMNAKMT2A
SCHEMBL6800670 0.75 KMT2A (0.56) ALDH1A1MAPTLMNAKMT2AMEN1
SCHEMBL7366081 0.72 STAT3 (0.42) ALDH1A1LMNAKMT2AMEN1PSMD10
SCHEMBL2656976 0.71 SIRT1 (0.44) ALDH1A1LMNAKMT2ASMN1; SMN2
SCHEMBL3868295 0.71 CA12 (0.41) ALDH1A1KMT2AMEN1PSMD10
SCHEMBL6489184 0.71 KDM4E (0.40) ALDH1A1PSMD10NPC1RAB9ASMN1; SMN2
SCHEMBL3483301 0.70 PSMD10 (0.41) ALDH1A1MAPTPOLBKMT2AMEN1
SCHEMBL60443 0.69 STAT3 (0.50) ALDH1A1LMNAKMT2AMEN1PKM
SCHEMBL15456206 0.69 LMNA (0.41) ALDH1A1MAPTLMNAPOLBKMT2A

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-1326835-A1 BENZAMIDE COMPOUNDS AS APO B SECRETION INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-07-16 EP disclosed
WO-2002028835-A1 BENZAMIDE COMPOUNDS AS APO B SECRETION INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-04-11 WO disclosed