SCHEMBL5659640

SCHEMBL5659640

CCOC(=O)CCc1cn(Cc2sc(-c3ccc(C(F)(F)F)cc3)nc2C)c2ccc(OC)cc12

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 14/20 0.49
PPARA Q07869 11/20 0.49
PPARG P37231 7/20 0.49
PTPN1 P18031 2/20 0.44
FFAR1 O14842 4/20 0.43
MAPT P10636 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
HSP90AA1 P07900 1/20 0.42
CRHBP P24387 1/20 0.42
KMT2A Q03164 1/20 0.42
CRHR2 Q13324 1/20 0.42

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
SCHEMBL5660147 0.91 PPARD (0.59) PPARDPPARAPPARGPTPN1FFAR1
SCHEMBL5661290 0.81 PPARD (0.55) PPARDPPARAPPARGFFAR1MAPT
SCHEMBL5660103 0.80 PPARD (0.54) PPARDPPARAPPARGPTPN1FFAR1
SCHEMBL5015393 0.80 PPARD (0.58) PPARDPPARAPPARGFFAR1
SCHEMBL5657706 0.78 PPARD (0.55) PPARDPPARAPPARGPTPN1FFAR1
SCHEMBL5015451 0.78 PPARD (0.59) PPARDPPARAPPARGFFAR1MAPT
SCHEMBL5015494 0.75 PPARD (0.60) PPARDPPARAPPARGFFAR1
SCHEMBL5015502 0.75 PPARD (0.62) PPARDPPARAPPARGFFAR1
SCHEMBL4604936 0.73 MTNR1A (0.45) PPARDPPARAPPARGMAPTMEN1
SCHEMBL4674166 0.73 PPARD (0.53) PPARDPPARAPPARGFFAR1MAPT

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 PPARD 3/4885PPARA 2/4885PPARG 1/4885

“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.