SCHEMBL8926283

SCHEMBL8926283

CCCCCCCN(CCCc1ccc(OC(C)(C)C(=O)O)cc1)C(=O)Nc1ccc(OC)cc1OC

nearest known ligand 0.68

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 15/20 0.68
PPARG P37231 12/20 0.68
PPARD Q03181 7/20 0.62
PLK1 P53350 1/20 0.47
PLK3 Q9H4B4 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
MAPT P10636 1/20 0.44

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
SCHEMBL6941878 0.97 PPARA (0.72) PPARAPPARGPPARDPLK1PLK3
SCHEMBL8767784 0.93 PPARA (0.61) PPARAPPARGPPARDMAPT
SCHEMBL8768686 0.93 PPARA (0.61) PPARAPPARGPPARDMAPT
SCHEMBL8767727 0.93 PPARA (0.61) PPARAPPARGPPARDMAPT
SCHEMBL8767679 0.92 PPARA (0.59) PPARAPPARGPPARDMAPT
SCHEMBL6359190 0.89 PPARA (0.61) PPARAPPARGPPARDMEN1KMT2A
SCHEMBL8925577 0.88 PPARA (0.60) PPARAPPARGPPARDPLK1PLK3
SCHEMBL8768851 0.87 PPARA (0.67) PPARAPPARGPPARDMAPT
SCHEMBL8768153 0.86 PPARA (0.58) PPARAPPARGPPARDPLK1PLK3
SCHEMBL8767593 0.85 PPARA (0.67) PPARAPPARGPPARDPLK1

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