SCHEMBL4732276

SCHEMBL4732276

Cc1cc2c(cc1S(=O)(=O)NCC1CCOCC1)S(=O)(=O)c1cc(F)ccc1O2

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 12/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CNR1 P21554 4/20 0.38
TP53 P04637 1/20 0.38
MKNK2 Q9HBH9 1/20 0.37
MAPT P10636 1/20 0.36

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
SCHEMBL4733368 0.91 CHRM2 (0.41) CNR2MEN1KMT2AMKNK2MAPT
SCHEMBL4730455 0.85 USP30 (0.39) TP53MKNK2MAPT
SCHEMBL4731712 0.81 ALDH1A1 (0.51) CNR2MEN1KMT2A
SCHEMBL4781177 0.80 KMT2A (0.49) KMT2ATP53MAPT
SCHEMBL4732610 0.78 NR2F2 (0.51) MAPT
SCHEMBL4730716 0.77 SLC2A1 (0.45) TP53
SCHEMBL4730919 0.76 POLB (0.58) MEN1KMT2A
SCHEMBL4734747 0.75 KMT2A (0.48) MEN1KMT2ATP53MAPT
SCHEMBL4733867 0.75 MEN1 (0.46) MEN1KMT2A
SCHEMBL4731336 0.75 CNR2 (0.39) CNR2MEN1KMT2ACNR1TP53

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