SCHEMBL2467888

SCHEMBL2467888

CCCCCCc1nc(-c2ccccc2C(F)(F)F)sc1CCC(=O)c1ccc(OCC(=O)OCC)c(C)c1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
THRA P10827 3/20 0.39
THRB P10828 3/20 0.39
PPARA Q07869 7/20 0.36
PPARG P37231 5/20 0.36
ABCB1 P08183 1/20 0.36
PPARD Q03181 9/20 0.36
ESR1 P03372 1/20 0.35
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP3A4 P08684 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
ALOX15 P16050 1/20 0.34
KMT2A Q03164 1/20 0.34
HSD17B10 Q99714 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
FFAR1 O14842 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34

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
SCHEMBL2467448 0.92 PPARD (0.43) THRATHRBPPARAPPARGPPARD
SCHEMBL2463832 0.87 PPARA (0.39) THRATHRBPPARAPPARGPPARD
SCHEMBL6888377 0.86 THRA (0.38) THRATHRBPPARAPPARGPPARD
SCHEMBL2460829 0.86 PPARA (0.42) THRATHRBPPARAPPARGPPARD
SCHEMBL2465204 0.84 PPARD (0.46) PPARAPPARGPPARDMEN1ALDH1A1
SCHEMBL2465706 0.83 PPARA (0.39) THRATHRBPPARAPPARGPPARD
SCHEMBL2463129 0.81 PPARA (0.42) THRATHRBPPARAPPARGPPARD
SCHEMBL2467445 0.79 PPARD (0.59) PPARAPPARGPPARDFFAR1
SCHEMBL12732402 0.79 PPARD (0.52) PPARAPPARGPPARDMAPTFFAR1
SCHEMBL2468793 0.79 PPARD (0.56) PPARAPPARGPPARDMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1424330-B1 ACTIVATOR FOR PEROXISOME PROLIFERATOR-RESPONSIVE RECEPTOR DELTA NIPPON CHEMIPHAR CO (JP) 2011-09-28 EP disclosed