SCHEMBL4783541

SCHEMBL4783541

CC(C)c1cccc2c1c(S(=O)(=O)NC1CCN(C(=S)Nc3cccc(C(=O)O)c3)CC1)cn2S(=O)(=O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SFRP1 Q8N474 4/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 1/20 0.39
POLB P06746 2/20 0.38
TP53 P04637 1/20 0.38
ATM Q13315 1/20 0.38
NPY2R P49146 1/20 0.38
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
USP2 O75604 1/20 0.37
GAA P10253 1/20 0.37

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
SCHEMBL4785401 0.85 SFRP1 (0.54) SFRP1MEN1KMT2AALDH1A1
SCHEMBL4784223 0.84 HTR1A (0.42) SFRP1
SCHEMBL4782531 0.82 SFRP1 (0.53) SFRP1MEN1KMT2AALDH1A1POLB
SCHEMBL4783673 0.80 CCR8 (0.51) ALDH1A1USP2
SCHEMBL14208234 0.80 HTR6 (0.49) SFRP1ALDH1A1
SCHEMBL4802468 0.80 HTR1A (0.46) CYP3A4
SCHEMBL4781850 0.79 SFRP1 (0.44) SFRP1MEN1KMT2A
SCHEMBL4782745 0.79 SFRP1 (0.52) SFRP1
SCHEMBL14207899 0.78 HTR6 (0.43) MEN1KMT2AALDH1A1
SCHEMBL4784467 0.77 HTR6 (0.42) MEN1KMT2A

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-2008060998-A1 INDOLE SULFONAMIDES AS SFRP-1 MODULATORS WYETH (US) 2008-05-22 WO claimed
WO-2008060998-A1 INDOLE SULFONAMIDES AS SFRP-1 MODULATORS WYETH (US) 2008-05-22 WO disclosed