SCHEMBL4783289

SCHEMBL4783289

CC(C)(C)OC(=O)N1CCC(NS(=O)(=O)c2cccc(Cl)c2Cl)CC1

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
STS P08842 6/20 0.63
CCR8 P51685 1/20 0.56
BRD4 O60885 2/20 0.55
SFRP1 Q8N474 4/20 0.52
ALDH1A1 P00352 2/20 0.49
NPC1 O15118 1/20 0.49
MAPT P10636 1/20 0.49
MAPK1 P28482 1/20 0.49
HTT P42858 1/20 0.49
RAB9A P51151 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
EPHX2 P34913 2/20 0.48
NR1H2 P55055 1/20 0.47

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
SCHEMBL4785389 0.83 ALDH1A1 (0.51) STSCCR8SFRP1ALDH1A1L3MBTL1
SCHEMBL4734558 0.82 STS (0.57) STSCCR8BRD4SFRP1ALDH1A1
SCHEMBL15932397 0.82 CCR8 (0.60) STSCCR8BRD4SFRP1ALDH1A1
SCHEMBL31234649 0.82 CCR8 (0.60) STSCCR8BRD4SFRP1ALDH1A1
SCHEMBL5568808 0.81 STS (0.54) STSCCR8BRD4SFRP1ALDH1A1
SCHEMBL4573343 0.81 STS (0.53) STSCCR8BRD4SFRP1ALDH1A1
SCHEMBL7533683 0.81 STS (0.73) STSCCR8BRD4SFRP1ALDH1A1
SCHEMBL4736604 0.80 SFRP1 (0.67) STSCCR8BRD4SFRP1NR1H2
SCHEMBL4781795 0.80 ALDH1A1 (0.52) SFRP1ALDH1A1MAPTL3MBTL1
SCHEMBL1338938 0.80 CCR8 (0.66) STSCCR8BRD4SFRP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008061016-A1 N-SUBSTITUTED PIPERIDINYL 4 -ARYLSULFONAMIDES AS MODULATORS OF THE SECRETED FRIZZLED RELATED PROTEIN- 1 WYETH (US) 2008-05-22 WO disclosed