SCHEMBL6615067

SCHEMBL6615067

Cc1cc(OC(C)c2oc(-c3ccccc3OC3CCCC3)nc2C(C)C)ccc1CCC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 13/20 0.41
PTGDR Q13258 2/20 0.39
PPARG P37231 11/20 0.38
PPARA Q07869 11/20 0.38
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
RXRG P48443 1/20 0.38
FFAR1 O14842 4/20 0.37
DRD4 P21917 1/20 0.36
ADRA1D P25100 1/20 0.36
DRD3 P35462 1/20 0.36
FFAR4 Q5NUL3 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
SCHEMBL5220200 0.87 FFAR1 (0.42) PPARDPPARGPPARAFFAR1DRD4
SCHEMBL6615068 0.86 PPARD (0.43) PPARDPPARGPPARA
SCHEMBL5218871 0.86 FFAR1 (0.46) PPARDPPARGPPARAFFAR1DRD4
SCHEMBL5850720 0.81 FFAR1 (0.47) PPARDPPARGPPARAFFAR1DRD4
SCHEMBL5852086 0.81 PPARG (0.49) PPARDPPARGPPARAFFAR1FFAR4
SCHEMBL5850594 0.80 FFAR1 (0.50) PPARDPPARGPPARAFFAR1DRD4
SCHEMBL5850650 0.79 FFAR1 (0.46) PPARDPPARGPPARAFFAR1FFAR4
SCHEMBL5850592 0.77 PPARG (0.44) PPARDPPARGPPARAFFAR1FFAR4
SCHEMBL5850617 0.77 PPARD (0.46) PPARDPPARGPPARAFFAR1
SCHEMBL5850600 0.77 FFAR4 (0.46) PPARDPPARGPPARAFFAR1FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1480640-A1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2004-12-01 EP disclosed
WO-2003072100-A1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2003-09-04 WO disclosed