SCHEMBL5658432

SCHEMBL5658432

CCCCc1ccc(S(=O)(=O)n2cc(CCC(=O)O)c3cc(OC(C)C)ccc32)cc1

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.66
PPARD Q03181 6/20 0.66
PPARA Q07869 6/20 0.66
PLA2G4A P47712 2/20 0.53
HTR6 P50406 12/20 0.47
HTR1A P08908 1/20 0.46
DRD2 P14416 1/20 0.46
HTR1D P28221 1/20 0.46
HTR1B P28222 1/20 0.46
HTR1E P28566 1/20 0.46
HTR1F P30939 1/20 0.46
HTR7 P34969 1/20 0.46
DRD3 P35462 1/20 0.46

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
SCHEMBL14572765 0.93 PPARG (0.56) PPARGPPARDPPARAPLA2G4AHTR6
SCHEMBL5662632 0.92 PPARG (0.67) PPARGPPARDPPARAPLA2G4AHTR6
SCHEMBL3029280 0.91 PPARG (0.81) PPARGPPARDPPARAHTR6HTR1A
SCHEMBL3029582 0.90 PPARG (0.67) PPARGPPARDPPARAPLA2G4AHTR6
SCHEMBL14605661 0.88 PPARG (0.72) PPARGPPARDPPARAPLA2G4AHTR6
SCHEMBL5661760 0.88 PPARG (0.86) PPARGPPARDPPARAHTR6HTR1A
SCHEMBL3018746 0.87 PPARG (0.72) PPARGPPARDPPARAPLA2G4AHTR6
SCHEMBL5656582 0.87 PPARG (0.71) PPARGPPARDPPARAPLA2G4AHTR6
SCHEMBL5663266 0.87 PPARG (0.71) PPARGPPARDPPARAPLA2G4AHTR6
SCHEMBL3033432 0.87 PPARG (0.84) PPARGPPARDPPARAHTR6HTR1A

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 4 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
WO-2007030559-A2 1, 3-DISUBSTITUTED INDOLE DERIVATIVES FOR USE AS PPAR MODULATORS PLEXXIKON, INC. (US) 2007-03-15 WO 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.