SCHEMBL5659144

SCHEMBL5659144

CCCCOc1ccc(S(=O)(=O)n2cc(CCC(=O)O)c3ccc(OC(C)C)cc32)cc1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 5/20 0.56
▸ PPARD Q03181 5/20 0.56
▸ PPARA Q07869 5/20 0.56
▸ RORC P51449 2/20 0.46
▸ HTR6 P50406 2/20 0.46
▸ PLA2G4A P47712 2/20 0.44
▸ PTGDR Q13258 3/20 0.43
▸ PTGDR2 Q9Y5Y4 5/20 0.42
▸ PSEN1 P49768 1/20 0.41
▸ PSEN2 P49810 1/20 0.41
▸ APH1B Q8WW43 1/20 0.41
▸ NCSTN Q92542 1/20 0.41
▸ APH1A Q96BI3 1/20 0.41
▸ PSENEN Q9NZ42 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
SCHEMBL5662632 0.93 PPARG (0.67) PPARGPPARDPPARAHTR6PLA2G4A
SCHEMBL14572765 0.92 PPARG (0.56) PPARGPPARDPPARARORCHTR6
SCHEMBL5661575 0.90 PPARG (0.58) PPARGPPARDPPARARORCHTR6
SCHEMBL5663988 0.88 PPARG (0.72) PPARGPPARDPPARARORCHTR6
SCHEMBL4619895 0.86 PPARG (0.68) PPARGPPARDPPARARORCHTR6
SCHEMBL4619961 0.86 PPARG (0.68) PPARGPPARDPPARARORCHTR6
SCHEMBL14605565 0.85 PPARG (0.62) PPARGPPARDPPARAHTR6PLA2G4A
SCHEMBL5658432 0.84 PPARG (0.66) PPARGPPARDPPARAHTR6PLA2G4A
SCHEMBL14572772 0.84 PPARG (0.66) PPARGPPARDPPARAHTR6PLA2G4A
SCHEMBL5662675 0.84 PPARG (0.55) PPARGPPARDPPARARORCHTR6

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.

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