SCHEMBL8925577

SCHEMBL8925577

CCCCCCCN(CCc1ccc(OC(C)(C)C(=O)OCC)cc1)C(=O)Nc1ccc(OC)cc1OC

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 10/20 0.60
PPARG P37231 9/20 0.60
PPARD Q03181 5/20 0.54
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.43
HTT P42858 1/20 0.43
TSHR P16473 1/20 0.43
PLK1 P53350 1/20 0.42
PLK3 Q9H4B4 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
MAPT P10636 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
SCHEMBL8768980 0.92 PPARA (0.50) PPARAPPARGPPARDLMNAGAA
SCHEMBL6941878 0.91 PPARA (0.72) PPARAPPARGPPARDPLK1PLK3
SCHEMBL8926283 0.88 PPARA (0.68) PPARAPPARGPPARDPLK1PLK3
SCHEMBL8768153 0.87 PPARA (0.58) PPARAPPARGPPARDLMNAGAA
SCHEMBL8768806 0.86 PPARA (0.50) PPARAPPARGPPARDLMNAGAA
SCHEMBL8768099 0.85 TSHR (0.52) PPARAPPARGPPARDLMNAGAA
SCHEMBL8768837 0.85 PPARG (0.82) PPARAPPARGPPARD
SCHEMBL8767877 0.83 HDAC6 (0.59) PPARAPPARGPPARDTSHR
SCHEMBL8925426 0.83 PPARA (0.45) PPARAPPARGPPARDLMNAGAA
SCHEMBL8767784 0.82 PPARA (0.61) PPARAPPARGPPARDGAAHTT

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
US-5658944-A ANTICHOLESTEROL AGENTS THE UNIVERSITY OF SOUTH CAROLINA (US) 1997-08-19 US disclosed