SCHEMBL5658965

SCHEMBL5658965

COc1cc2c(CCC(=O)O)cn(S(=O)(=O)c3cccc4cccnc34)c2cc1OC

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.48
PPARD Q03181 1/20 0.48
PPARA Q07869 1/20 0.48
TSHR P16473 2/20 0.46
HTT P42858 1/20 0.46
POLB P06746 2/20 0.45
KMT2A Q03164 1/20 0.45
LMNA P02545 4/20 0.44
MAPK1 P28482 3/20 0.44
HTR6 P50406 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 1/20 0.43
MAPT P10636 2/20 0.42
HSP90AA1 P07900 1/20 0.41
PLA2G4A P47712 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL5660292 0.88 PPARG (0.64) PPARGPPARDPPARAHTR6
SCHEMBL14605629 0.87 TSHR (0.49) PPARGPPARDPPARATSHRHTT
SCHEMBL5664139 0.84 PPARG (0.53) PPARGPPARDPPARATSHRHTT
SCHEMBL5660994 0.84 TSHR (0.46) PPARGPPARDPPARATSHRHTT
SCHEMBL5659100 0.84 PKM (0.48) PPARGPPARDPPARATSHRHTT
SCHEMBL5661092 0.82 PPARG (0.53) PPARGPPARDPPARAHTR6PLA2G4A
SCHEMBL5660404 0.81 HTR6 (0.56) PPARGPPARDPPARAHTR6MAPT
SCHEMBL5660692 0.80 PPARG (0.52) PPARGPPARDPPARAHTR6PLA2G4A
SCHEMBL5662194 0.79 PPARG (0.53) PPARGPPARDPPARAHTR6PLA2G4A
SCHEMBL5660877 0.79 PPARG (0.56) PPARGPPARDPPARAHTR6PLA2G4A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070072904-A1 1-arylsulfone-substituted indole carboxylic acids or amides; peroxisome proliferator-activated receptor PPAR modulators; obesity, diabetes, cardiovascular disorders PLEXXIKON INC 2007-03-29 US disclosed
US-20070072904-A1 1-arylsulfone-substituted indole carboxylic acids or amides; peroxisome proliferator-activated receptor PPAR modulators; obesity, diabetes, cardiovascular disorders PLEXXIKON INC 2007-03-29 US disclosed
US-20070072904-A1 1-arylsulfone-substituted indole carboxylic acids or amides; peroxisome proliferator-activated receptor PPAR modulators; obesity, diabetes, cardiovascular disorders PLEXXIKON INC 2007-03-29 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070072904-A1 1-arylsulfone-substituted indole carboxylic acids or amides; peroxisome proliferator-activated receptor PPAR modulators; obesity, diabetes, cardiovascular disorders PPARG, PPARA, PPARD PPARG 1/4885PPARD 3/4885PPARA 2/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.