SCHEMBL4732136

SCHEMBL4732136

Cc1cc2c(cc1S(=O)(=O)NCCc1ccncc1)S(=O)(=O)c1ccccc1CC2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
HTT P42858 6/20 0.47
PKM P14618 1/20 0.47
MAPK1 P28482 1/20 0.47
TDP1 Q9NUW8 1/20 0.46
ALDH1A1 P00352 5/20 0.44
LMNA P02545 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
SFRP1 Q8N474 1/20 0.42
NPC1 O15118 1/20 0.41
NR2F2 P24468 1/20 0.41
NOD2 Q9HC29 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
POLB P06746 2/20 0.40
NPSR1 Q6W5P4 1/20 0.39
TSHR P16473 1/20 0.39
BRD4 O60885 1/20 0.39
BRD2 P25440 1/20 0.39
BRD3 Q15059 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
SCHEMBL4733822 0.92 SFRP1 (0.50) MEN1KMT2AHTTPKMTDP1
SCHEMBL4733942 0.89 POLB (0.48) HTTTDP1ALDH1A1SMN1; SMN2SFRP1
SCHEMBL4729813 0.85 SFRP1 (0.50) MEN1KMT2AHTTPKMTDP1
SCHEMBL4733520 0.85 MEN1 (0.48) MEN1KMT2A
SCHEMBL4734599 0.83 POLB (0.48) MEN1KMT2AHTTPKMMAPK1
SCHEMBL4732336 0.82 AKR1C3 (0.41) PKMTDP1ALDH1A1LMNASMN1; SMN2
SCHEMBL4733929 0.81 PARG (0.39) MEN1KMT2AHTTTDP1LMNA
SCHEMBL4734109 0.78 MEN1 (0.43) MEN1KMT2AHTTPKMMAPK1
SCHEMBL4734759 0.78 MEN1 (0.45) MEN1KMT2AHTTPKMMAPK1
SCHEMBL4730493 0.77 ALDH1A1 (0.40) MEN1KMT2AHTTPKMMAPK1

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