SCHEMBL2312698

SCHEMBL2312698

COc1ccc2c(ccn2S(=O)(=O)c2cccc(NCCN(C)C)c2C)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 7/20 0.50
POLB P06746 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
FABP4 P15090 3/20 0.48
HDAC1 Q13547 3/20 0.44
HDAC6 Q9UBN7 2/20 0.44
PPARG P37231 2/20 0.43
PPARD Q03181 2/20 0.43
PPARA Q07869 2/20 0.43
NQO2 P16083 3/20 0.42
RAD52 P43351 1/20 0.42
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC10 Q969S8 1/20 0.39
HDAC11 Q96DB2 1/20 0.39
HDAC8 Q9BY41 1/20 0.39

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
SCHEMBL2008376 0.82 HTR6 (0.54) HTR6POLBL3MBTL1FABP4HDAC1
SCHEMBL2005448 0.79 HTR6 (0.53) HTR6POLBL3MBTL1FABP4HDAC1
SCHEMBL2013274 0.79 FABP4 (0.48) HTR6POLBL3MBTL1FABP4HDAC1
SCHEMBL2009721 0.77 HTR6 (0.53) HTR6POLBL3MBTL1FABP4HDAC1
SCHEMBL2007979 0.76 NQO2 (0.42) HTR6NQO2RAD52NQO1HTR1A
SCHEMBL2314057 0.75 FABP4 (0.47) HTR6L3MBTL1FABP4PPARGNQO2
SCHEMBL1973097 0.72 HTR6 (0.63) HTR6POLBL3MBTL1FABP4HDAC1
SCHEMBL2011566 0.72 CPT1A (0.49) HTR6POLBFABP4MEN1KMT2A
SCHEMBL1976660 0.71 HTR6 (0.61) HTR6POLBL3MBTL1FABP4HDAC1
SCHEMBL31159459 0.71 HTR6 (0.68) HTR6POLBL3MBTL1FABP4HDAC1

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
EP-2200980-B1 AMINO ARYLSULFONAMIDE COMPOUNDS AND THEIR USE AS 5-HT6 LIGANDS FIELD OF INVENTION SUVEN LIFE SCIENCES LTD (IN) 2011-08-03 EP claimed