SCHEMBL8767780

SCHEMBL8767780

CC(C)(Oc1ccc(CN(C(=O)Nc2ccc(F)cc2F)C(C)(C)C)cc1)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 15/20 0.62
PPARG P37231 9/20 0.62
PPARD Q03181 5/20 0.61
SOAT1 P35610 1/20 0.47
HTT P42858 1/20 0.46
NPC1 O15118 1/20 0.41
GAA P10253 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL8926594 0.88 PPARA (0.52) PPARAPPARGPPARDSOAT1HTT
SCHEMBL8925066 0.82 PPARA (0.85) PPARAPPARGPPARDSOAT1
SCHEMBL8768931 0.81 PPARA (0.52) PPARAPPARGPPARDHTTNPC1
SCHEMBL14345218 0.78 PPARA (0.61) PPARAPPARGPPARDHTTNPC1
SCHEMBL8159724 0.77 PPARA (1.00) PPARAPPARGPPARDSOAT1
SCHEMBL9265603 0.74 HTT (0.68) SOAT1HTTRAB9A
SCHEMBL14345568 0.74 PPARA (0.56) PPARAPPARGPPARDHTTNPC1
SCHEMBL8768601 0.72 PPARG (0.70) PPARAPPARGPPARDSOAT1HTT
SCHEMBL8767793 0.72 POLB (0.53) PPARAPPARGPPARDHTTNPC1
SCHEMBL14345276 0.70 PPARA (0.53) PPARAPPARGPPARDNPC1RAB9A

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-0639178-B1 ANTI-ATHEROSCLEROTIC ARYL COMPOUNDS WELLCOME FOUND (GB) 1997-09-03 EP disclosed