SCHEMBL4604332

SCHEMBL4604332

CCOc1ccc(-c2ccc(S(=O)(=O)n3cc(CCC(=O)O)c4cc(Cl)ccc43)s2)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.49
PPARD Q03181 2/20 0.49
PPARA Q07869 2/20 0.49
PLA2G4A P47712 2/20 0.43
HTR6 P50406 2/20 0.40
TP53 P04637 1/20 0.39
MMP13 P45452 12/20 0.39
MMP1 P03956 3/20 0.39
MMP2 P08253 1/20 0.38
MMP3 P08254 1/20 0.38
MMP7 P09237 1/20 0.38
MMP9 P14780 1/20 0.38
MMP14 P50281 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.38

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
SCHEMBL4606105 0.95 PPARG (0.52) PPARGPPARDPPARAPLA2G4AHTR6
SCHEMBL5660710 0.93 PPARG (0.55) PPARGPPARDPPARAPLA2G4AHTR6
SCHEMBL4604370 0.91 PPARG (0.49) PPARGPPARDPPARAPLA2G4AHTR6
SCHEMBL4605981 0.91 PPARG (0.62) PPARGPPARDPPARAPLA2G4AHTR6
SCHEMBL4605289 0.90 PPARG (0.47) PPARGPPARDPPARAPLA2G4AHTR6
SCHEMBL4621227 0.90 PPARG (0.52) PPARGPPARDPPARAPLA2G4AHTR6
SCHEMBL4605192 0.90 PPARG (0.49) PPARGPPARDPPARAPLA2G4AMMP13
SCHEMBL4607890 0.89 HTR6 (0.46) PPARGPPARDPPARAPLA2G4AHTR6
SCHEMBL4621223 0.88 PPARG (0.50) PPARGPPARDPPARAPLA2G4AHTR6
SCHEMBL4605005 0.88 PPARG (0.52) PPARGPPARDPPARAPLA2G4AHTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1943245-A2 1,3-DISUBSTITUTED INDOLE DERIVATIVES FOR USE AS PPAR MODULATORS PLEXXIKON, INC. (US) 2008-07-16 EP 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
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.