SCHEMBL6035852

SCHEMBL6035852

Cc1nn(-c2ccc(C(F)(F)F)cn2)cc1CCCOc1cccc(OC(C)(C)C(=O)O)c1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 13/20 0.44
PPARG P37231 11/20 0.44
PPARD Q03181 10/20 0.44
SMN1; SMN2 Q16637 2/20 0.39
IDE P14735 1/20 0.39
CYP4F2 P78329 2/20 0.38
CYP4A11 Q02928 2/20 0.38
MCL1 Q07820 1/20 0.36
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL6035801 0.91 PPARD (0.45) PPARAPPARGPPARDSMN1; SMN2IDE
SCHEMBL1634400 0.89 PPARA (0.40) PPARAPPARGPPARDSMN1; SMN2IDE
SCHEMBL6034617 0.89 PPARA (0.42) PPARAPPARGPPARDSMN1; SMN2IDE
SCHEMBL6035559 0.89 PPARA (0.40) PPARAPPARGPPARDSMN1; SMN2IDE
SCHEMBL6035851 0.89 PPARA (0.46) PPARAPPARGPPARDSMN1; SMN2IDE
SCHEMBL6035156 0.87 PPARA (0.40) PPARAPPARGPPARDSMN1; SMN2IDE
SCHEMBL6034586 0.86 PPARA (0.40) PPARAPPARGPPARDSMN1; SMN2IDE
SCHEMBL6035650 0.85 PLA2G4B (0.39) PPARAPPARGPPARDSMN1; SMN2IDE
SCHEMBL6034603 0.85 PPARA (0.41) PPARAPPARGPPARDSMN1; SMN2IDE
SCHEMBL6035033 0.81 PPARA (0.52) PPARAPPARGPPARDSMN1; SMN2

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-20060148858-A1 1, 2-Azole derivatives with hypoglycemic and hypolipidemic activity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-07-06 US disclosed
EP-1513817-A1 1, 2-AZOLE DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY Takeda Pharmaceutical Company Limited (JP) 2005-03-16 EP disclosed
WO-2003099793-A1 1,2-AZOLE DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2003-12-04 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-20060148858-A1 1, 2-Azole derivatives with hypoglycemic and hypolipidemic activity GPR119, SLC5A1, CYP4B1 PPARA 1717/4885PPARG 1037/4885PPARD 2488/4885

“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.