SCHEMBL7108719

SCHEMBL7108719

CCOC(=O)C(C)(C)OCc1cccc(OC(C)Cc2sc(-c3ccc(C(F)(F)F)cc3)nc2C)c1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 18/20 0.46
PPARA Q07869 15/20 0.46
PPARG P37231 7/20 0.46
FFAR1 O14842 3/20 0.43
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
HSP90AA1 P07900 1/20 0.42
MAPT P10636 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
SCHEMBL5847993 0.88 PPARD (0.57) PPARDPPARAPPARGFFAR1
SCHEMBL5848523 0.87 KDM4E (0.43) PPARDPPARAPPARGKDM4EMEN1
SCHEMBL7103151 0.86 PTPN1 (0.53) PPARDPPARAPPARGFFAR1
SCHEMBL5849746 0.85 PPARD (0.45) PPARDPPARAPPARGFFAR1KDM4E
SCHEMBL5848526 0.83 PPARA (0.47) PPARDPPARAPPARGFFAR1KDM4E
SCHEMBL5848492 0.79 PPARD (0.62) PPARDPPARAPPARGFFAR1
SCHEMBL5848682 0.77 PPARA (0.49) PPARDPPARAPPARG
SCHEMBL7107434 0.77 PPARD (0.60) PPARDPPARAPPARGFFAR1
SCHEMBL5847998 0.76 PPARD (0.48) PPARDPPARAPPARG
SCHEMBL6473326 0.75 PPARD (0.54) PPARDPPARAPPARGFFAR1KDM4E

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-1345916-A1 SUBSTITUTED OXAZOLES AND THIAZOLES AS HPPAR ALPHA AGONISTS GLAXO GROUP LIMITED (GB) 2003-09-24 EP disclosed
WO-2002050047-A1 SUBSTITUED OXAZOLES AND THIAZOLES AS HPPAR ALPHA AGONISTS GLAXO GROUP LIMITED (GB) 2002-06-27 WO disclosed