SCHEMBL4733893

SCHEMBL4733893

Cc1cc2c(cc1S(=O)(=O)NC1CCOCC1)S(=O)(=O)c1ccccc1CC2

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
HTT P42858 2/20 0.37
BRD4 O60885 7/20 0.36
BRD2 P25440 4/20 0.36
BRD3 Q15059 4/20 0.36
TP53 P04637 2/20 0.36
LMNA P02545 2/20 0.35
MAPT P10636 2/20 0.35
GAA P10253 1/20 0.35
TSHR P16473 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CCR8 P51685 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
CYP2C9 P11712 1/20 0.33

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
SCHEMBL4783144 0.90 HTT (0.46) HTTBRD4BRD2BRD3TP53
SCHEMBL4733255 0.87 BRD4 (0.44) KDM4EHTTBRD4BRD2BRD3
SCHEMBL4732992 0.87 CA1 (0.40) KDM4EHTTBRD4BRD2BRD3
SCHEMBL4733897 0.85 CNR2 (0.40) HTTTP53TSHRCCR8
SCHEMBL4733373 0.83 BRD4 (0.40) KDM4EBRD4TP53LMNATSHR
SCHEMBL4736205 0.79 HTT (0.35) HTTBRD4BRD2BRD3TP53
SCHEMBL4796518 0.79 KDM4E (0.33) KDM4EHTTBRD4GAA
SCHEMBL4732186 0.77 HTT (0.36) HTTBRD4BRD2BRD3TP53
SCHEMBL4729711 0.77 ALDH1A1 (0.52) KDM4ETSHRMEN1KMT2AL3MBTL1
SCHEMBL4732359 0.77 BRD4 (0.36) HTTBRD4BRD2BRD3TP53

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
WO-2008061029-A1 ARYL SULFONAMIDE DERIVATIVES AND METHODS OF THEIR USE WYETH (US) 2008-05-22 WO claimed
WO-2008061029-A1 ARYL SULFONAMIDE DERIVATIVES AND METHODS OF THEIR USE WYETH (US) 2008-05-22 WO disclosed