SCHEMBL4730503

SCHEMBL4730503

CC(C)c1cc2c(cc1S(=O)(=O)NCc1ccccc1)S(=O)(=O)c1cc(F)ccc1CC2

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.47
KMT2A Q03164 2/20 0.47
GNRHR P30968 1/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.37
LMNA P02545 3/20 0.36
POLB P06746 2/20 0.36
SLC12A2 P55011 1/20 0.36
SLC12A5 Q9H2X9 1/20 0.36
GLA P06280 1/20 0.36
ALDH1A1 P00352 1/20 0.36
BRD4 O60885 1/20 0.36
ACHE P22303 1/20 0.36
CYP19A1 P11511 1/20 0.36
MMP3 P08254 1/20 0.35
MMP8 P22894 1/20 0.35
MCL1 Q07820 1/20 0.35

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
SCHEMBL4732619 0.90 TAAR1 (0.43) SMN1; SMN2KMT2ALMNAPOLBALDH1A1
SCHEMBL4733242 0.89 TDP1 (0.42) SMN1; SMN2KMT2ALMNAPOLBALDH1A1
SCHEMBL4731425 0.84 KMT2A (0.40) SMN1; SMN2KMT2ALMNAALDH1A1
SCHEMBL4734310 0.83 AKR1C3 (0.38) SMN1; SMN2LMNAPOLBALDH1A1
SCHEMBL4734133 0.82 TBXAS1 (0.40) SMN1; SMN2KMT2APOLBALDH1A1
SCHEMBL4732031 0.81 ALDH1A1 (0.41) SMN1; SMN2KMT2ALMNAALDH1A1
SCHEMBL4733452 0.81 CNR2 (0.39) KMT2A
SCHEMBL4731644 0.81 ACHE (0.44) LMNAALDH1A1ACHE
SCHEMBL4736402 0.80 HTR1A (0.38) KMT2A
SCHEMBL4732339 0.80 NAMPT (0.38) BRD4

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