SCHEMBL4815832

SCHEMBL4815832

COc1ccc(S(=O)(=O)n2cc(CCC(=O)O)c3ccccc32)cc1OC

nearest known ligand 0.75

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 14/20 0.75
PPARG P37231 2/20 0.62
PPARD Q03181 2/20 0.62
PPARA Q07869 2/20 0.62
PLA2G4A P47712 1/20 0.51
HTR1A P08908 1/20 0.50
DRD2 P14416 1/20 0.50
HTR1D P28221 1/20 0.50
HTR1B P28222 1/20 0.50
HTR1F P30939 1/20 0.50
HTR7 P34969 1/20 0.50
DRD3 P35462 1/20 0.50
PDE4A P27815 2/20 0.48
PDE4B Q07343 2/20 0.48
PDE4C Q08493 2/20 0.48
PDE4D Q08499 2/20 0.48

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
SCHEMBL3026928 0.88 PPARG (0.82) HTR6PPARGPPARDPPARAHTR1A
SCHEMBL5660150 0.86 PPARG (0.80) HTR6PPARGPPARDPPARAHTR1A
SCHEMBL350466 0.85 HTR6 (0.57) HTR6PPARGPPARDPPARAHTR1A
SCHEMBL3033927 0.83 HTR6 (0.71) HTR6PPARGPPARDPPARAHTR1A
SCHEMBL14605985 0.82 HTR6 (0.52) HTR6PPARGPPARDPPARAPLA2G4A
SCHEMBL8601386 0.81 AKR1C3 (0.64) HTR6PDE4APDE4BPDE4CPDE4D
SCHEMBL352179 0.81 PPARG (0.66) HTR6PPARGPPARDPPARAHTR1A
SCHEMBL351630 0.80 HTR6 (0.57) HTR6PPARGPPARDPPARAHTR1A
SCHEMBL13342680 0.80 PPARG (0.79) HTR6PPARGPPARDPPARAHTR1A
SCHEMBL15242234 0.80 PPARG (0.79) HTR6PPARGPPARDPPARAHTR1A

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-7348338-B2 PPAR active compounds PLEXXIKON, INC. (US) 2008-03-25 US claimed