SCHEMBL4782499

SCHEMBL4782499

CCc1cccc2c1c(S(=O)(=O)NC1CCN(C(=O)O)CC1)cn2S(=O)(=O)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 5/20 0.42
CCR8 P51685 9/20 0.42
SFRP1 Q8N474 4/20 0.41
WNT3 P56703 2/20 0.41
BRD4 O60885 1/20 0.40
RORC P51449 1/20 0.40

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
SCHEMBL4782099 0.89 SFRP1 (0.51) HTR6CCR8SFRP1WNT3BRD4
SCHEMBL4784223 0.86 HTR1A (0.42) HTR6CCR8SFRP1WNT3
SCHEMBL4782603 0.85 BRD4 (0.43) HTR6CCR8BRD4
SCHEMBL4782711 0.85 HTR6 (0.52) HTR6SFRP1WNT3
SCHEMBL4782800 0.84 CTSB (0.39) HTR6SFRP1WNT3
SCHEMBL4783460 0.84 SFRP1 (0.50) SFRP1WNT3
SCHEMBL4785454 0.81 CCR8 (0.51) CCR8
SCHEMBL4783673 0.80 CCR8 (0.51) CCR8
SCHEMBL4879740 0.79 SFRP1 (0.47) SFRP1WNT3
SCHEMBL4783752 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 1 patent. 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 disclosed