SCHEMBL4782800

SCHEMBL4782800

N#Cc1cccc2c1c(S(=O)(=O)NC1CCN(C(=O)O)CC1)cn2S(=O)(=O)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSB P07858 3/20 0.39
CTSK P43235 3/20 0.39
UCHL1 P09936 2/20 0.39
CTSS P25774 2/20 0.39
CTSC P53634 2/20 0.39
USP30 Q70CQ3 2/20 0.39
CTSL P07711 1/20 0.39
SFRP1 Q8N474 10/20 0.39
HTR6 P50406 3/20 0.38
THRB P10828 1/20 0.37
WNT3 P56703 2/20 0.37
HRH2 P25021 1/20 0.37
HRH1 P35367 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
SCHEMBL4782687 0.87 SFRP1 (0.49) SFRP1
SCHEMBL4784244 0.86 HTR6 (0.52) SFRP1HTR6WNT3
SCHEMBL4785881 0.86 HTR6 (0.41) CTSBCTSKUCHL1CTSSCTSC
SCHEMBL4783234 0.85 CCR8 (0.43) HRH2HRH1
SCHEMBL4782499 0.84 HTR6 (0.42) SFRP1HTR6WNT3
SCHEMBL4783460 0.83 SFRP1 (0.50) SFRP1WNT3
SCHEMBL4784223 0.83 HTR1A (0.42) SFRP1HTR6WNT3
SCHEMBL4734261 0.80 HRH2 (0.51) CTSBCTSKUCHL1CTSSCTSC
SCHEMBL4781544 0.80 SFRP1 (0.44) SFRP1HTR6THRB
SCHEMBL4879740 0.78 SFRP1 (0.47) SFRP1WNT3

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