SCHEMBL7136407

SCHEMBL7136407

CC[C@@H](CCCCO)CNS(=O)(=O)c1cccs1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.49
CYP2C19 P33261 2/20 0.49
CYP2D6 P10635 1/20 0.49
TSHR P16473 3/20 0.46
L3MBTL1 Q9Y468 3/20 0.45
GLA P06280 1/20 0.45
HTT P42858 1/20 0.45
LMNA P02545 2/20 0.43
RECQL P46063 2/20 0.43
ALDH1A1 P00352 6/20 0.42
HPGD P15428 2/20 0.42
POLB P06746 1/20 0.42
ESR2 Q92731 1/20 0.42
HSD17B10 Q99714 1/20 0.42
CYP3A4 P08684 1/20 0.41
TP53 P04637 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL7202062 0.96 CYP2C9 (0.50) CYP2C9CYP2C19CYP2D6TSHRL3MBTL1
SCHEMBL6988610 0.79 KMT2A (0.51) CYP2C9CYP2C19TSHRHTTLMNA
SCHEMBL6989273 0.75 KMT2A (0.35) CYP2C9CYP2C19CYP2D6TSHRL3MBTL1
SCHEMBL6986603 0.75 KMT2A (0.52) CYP2C9CYP2C19TSHRHTTLMNA
SCHEMBL5502622 0.74 CA1 (0.52) CYP2C9CYP2C19CYP2D6TSHRHTT
SCHEMBL5200239 0.73 CYP2C9 (0.66) CYP2C9CYP2C19CYP2D6TSHRL3MBTL1
SCHEMBL7194116 0.72 CYP2D6 (0.79) CYP2C9CYP2C19CYP2D6TSHRL3MBTL1
SCHEMBL5655445 0.71 CYP2D6 (0.72) CYP2C9CYP2C19CYP2D6TSHRL3MBTL1
SCHEMBL6989738 0.71 LMNA (0.47) CYP2C9CYP2C19CYP2D6TSHRL3MBTL1
SCHEMBL27601021 0.71 CYP2D6 (0.54) CYP2C9CYP2C19CYP2D6TSHRHTT

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-1341779-A2 HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION Wyeth (US) 2003-09-10 EP disclosed
WO-2002057252-A2 HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION WYETH (US) 2002-07-25 WO disclosed