SCHEMBL5514010

SCHEMBL5514010

CCCCN(CO)S(=O)(=O)c1ccccc1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.67
ESR2 Q92731 2/20 0.55
ESR1 P03372 2/20 0.54
MAPK1 P28482 1/20 0.54
NR1I2 O75469 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.50
SMN1; SMN2 Q16637 3/20 0.49
CA12 O43570 2/20 0.49
CA9 Q16790 2/20 0.49
CA2 P00918 1/20 0.49
RAB9A P51151 1/20 0.49
SLC22A6 Q4U2R8 1/20 0.49
SLC22A8 Q8TCC7 1/20 0.49
ABCC2 Q92887 1/20 0.49
SLC22A12 Q96S37 1/20 0.49
UGT1A7 Q9HAW7 1/20 0.49
SLC22A11 Q9NSA0 1/20 0.49
POLB P06746 3/20 0.48
LMNA P02545 2/20 0.48
HTT P42858 2/20 0.48

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
SCHEMBL2057475 0.91 TDP1 (0.73) TDP1ESR2ESR1MAPK1NR1I2
SCHEMBL9462807 0.88 TDP1 (0.69) TDP1ESR2ESR1MAPK1NR1I2
SCHEMBL13267917 0.87 MAPK1 (0.71) TDP1ESR2ESR1MAPK1NR1I2
SCHEMBL1278659 0.86 TDP1 (0.67) TDP1ESR2ESR1MAPK1NR1I2
SCHEMBL27539525 0.85 TDP1 (0.61) TDP1ESR2ESR1MAPK1NR1I2
SCHEMBL3482729 0.85 TDP1 (0.65) TDP1ESR2ESR1MAPK1NR1I2
SCHEMBL579010 0.84 TDP1 (0.64) TDP1ESR2ESR1MAPK1NR1I2
SCHEMBL29173159 0.84 TDP1 (0.64) TDP1ESR2ESR1MAPK1NR1I2
SCHEMBL8349234 0.84 TDP1 (0.64) TDP1ESR2ESR1MAPK1NR1I2
SCHEMBL18763131 0.84 TDP1 (0.64) TDP1ESR2ESR1MAPK1NR1I2

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-1549306-A4 SUBSTITUTED PHENYLSULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION WYETH CORP (US) 2007-06-06 EP claimed
EP-1549306-A1 SUBSTITUTED PHENYLSULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION Wyeth (US) 2005-07-06 EP claimed
WO-2003103660-A1 SUBSTITUTED PHENYLSULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION WYETH (US) 2003-12-18 WO claimed