SCHEMBL3533742

SCHEMBL3533742

CCN(CC)CCOc1cccc2c(S(=O)(=O)c3cccc4ccccc34)nn(Cc3cccc(Cl)c3)c12

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 14/20 0.44
DRD2 P14416 2/20 0.42
HTR2C P28335 2/20 0.42
HTR2B P41595 2/20 0.42
HTR1B P28222 2/20 0.40
HTR1D P28221 1/20 0.40
SLC6A9 P48067 1/20 0.37
AGER Q15109 1/20 0.36

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
SCHEMBL3531635 0.96 HTR6 (0.44) HTR6DRD2HTR2CHTR2BHTR1B
Hydrochloric Acid SCHEMBL3528624 0.91 HTR6 (0.41) HTR6DRD2HTR2CHTR2BHTR1B
SCHEMBL3529165 0.90 HTR6 (0.43) HTR6DRD2HTR2CHTR2BHTR1B
SCHEMBL3535899 0.89 TP53 (0.43) HTR6DRD2HTR1BHTR1DSLC6A9
SCHEMBL13342338 0.89 HTR6 (0.45) HTR6DRD2HTR2CHTR2B
SCHEMBL3532795 0.88 HTR6 (0.45) HTR6DRD2HTR2CHTR2BHTR1B
SCHEMBL3529592 0.88 HTR1B (0.44) HTR6DRD2HTR2CHTR2BHTR1B
SCHEMBL3532480 0.87 HTR6 (0.45) HTR6DRD2HTR2CHTR2BHTR1B
SCHEMBL3532484 0.87 HTR6 (0.44) HTR6DRD2HTR2CHTR2BHTR1B
SCHEMBL3529593 0.86 HTR6 (0.44) HTR6DRD2HTR2CHTR2BHTR1B

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
US-7723329-B2 Substituted-3-sulfonylindazole derivatives as 5-hydroxytryptamine-6 ligands WYETH LLC (US) 2010-05-25 US claimed