SCHEMBL4785401

SCHEMBL4785401

CC(C)c1cccc2c1c(S(=O)(=O)NC1CCN(S(=O)(=O)c3cccc(C(=O)O)c3)CC1)cn2S(=O)(=O)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SFRP1 Q8N474 4/20 0.54
ALDH1A1 P00352 6/20 0.47
KMT2A Q03164 6/20 0.46
MEN1 O00255 5/20 0.46
EPHX2 P34913 1/20 0.45
MAPT P10636 1/20 0.44
IL1RN P18510 1/20 0.44
KDM4E B2RXH2 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
LMNA P02545 1/20 0.42
GALK1 P51570 1/20 0.42

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
SCHEMBL4782531 0.93 SFRP1 (0.53) SFRP1ALDH1A1KMT2AMEN1EPHX2
SCHEMBL4730823 0.86 SFRP1 (0.62) SFRP1ALDH1A1KMT2AMEN1EPHX2
SCHEMBL4783541 0.85 SFRP1 (0.39) SFRP1ALDH1A1KMT2AMEN1
SCHEMBL4784223 0.85 HTR1A (0.42) SFRP1
SCHEMBL4781874 0.85 SFRP1 (0.67) SFRP1ALDH1A1KMT2AMEN1EPHX2
SCHEMBL4802468 0.84 HTR1A (0.46)
SCHEMBL14207899 0.82 HTR6 (0.43) ALDH1A1KMT2AMEN1LMNA
SCHEMBL4784467 0.82 HTR6 (0.42) KMT2AMEN1LMNA
SCHEMBL14208234 0.81 HTR6 (0.49) SFRP1ALDH1A1MAPT
SCHEMBL4783673 0.81 CCR8 (0.51) ALDH1A1KDM4ELMNA

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 3 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
WO-2008060998-A1 INDOLE SULFONAMIDES AS SFRP-1 MODULATORS WYETH (US) 2008-05-22 WO disclosed