SCHEMBL4635313

SCHEMBL4635313

Cc1ccc(S(=O)(=O)OCCOc2ccc3c(c2)c(S(=O)(=O)c2cccc4ccccc24)nn3Cc2cccc(Cl)c2)cc1.Clc1cccc(CBr)c1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 14/20 0.48
HTR2B P41595 4/20 0.47
DRD2 P14416 3/20 0.47
HTR2C P28335 3/20 0.47
TP53 P04637 2/20 0.38
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA9 Q16790 1/20 0.36
HTR1A P08908 1/20 0.34
HTR1D P28221 1/20 0.34
HTR1B P28222 1/20 0.34
GAA P10253 1/20 0.34

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
SCHEMBL3532161 0.96 HTR6 (0.51) HTR6HTR2BDRD2HTR2CTP53
SCHEMBL3531703 0.91 HTR6 (0.57) HTR6HTR2BDRD2HTR2CCA12
SCHEMBL3534239 0.82 HTR6 (0.52) HTR6HTR2BDRD2HTR2CTP53
SCHEMBL3532651 0.81 HTR6 (0.53) HTR6HTR2BDRD2HTR2CTP53
SCHEMBL3531338 0.81 HTR6 (0.53) HTR6HTR2BDRD2HTR2CTP53
SCHEMBL3532673 0.81 HTR6 (0.53) HTR6HTR2BDRD2HTR2CTP53
SCHEMBL3532315 0.81 HTR6 (0.53) HTR6HTR2BDRD2HTR2CCA12
SCHEMBL3532495 0.81 HTR6 (0.52) HTR6HTR2BDRD2HTR2CTP53
SCHEMBL3534496 0.80 HTR6 (0.52) HTR6HTR2BDRD2HTR2CTP53
SCHEMBL3532494 0.80 HTR6 (0.52) HTR6HTR2BDRD2HTR2CTP53

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
EP-1931640-A2 SUBSTITUTED-3-SULFONYLINDAZOLE DERIVATIVES AS 5-HYDROXYTRYPTAMINE-6 LIGANDS Wyeth a Corporation of the State of Delaware (US) 2008-06-18 EP disclosed
WO-2007021711-A2 SUBSTITUTED-3-SULFONYLINDAZOLE DERIVATIVES AS 5-HYDROXYTRYPTAMINE-6 LIGANDS WYETH (US) 2007-02-22 WO disclosed