SCHEMBL8925569

SCHEMBL8925569

CCCCCCCN(Cc1ccc(OC(C)(C)C(=O)OCC)cc1)C(=O)Nc1c(OCC)ccc2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 8/20 0.43
PPARG P37231 6/20 0.43
PPARD Q03181 2/20 0.42
TLR7 Q9NYK1 4/20 0.39
SOAT1 P35610 1/20 0.38
HDAC6 Q9UBN7 4/20 0.37
HDAC1 Q13547 3/20 0.37
HDAC3 O15379 2/20 0.37
HDAC2 Q92769 2/20 0.37
HDAC8 Q9BY41 2/20 0.37
ABCB11 O95342 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
TSHR P16473 1/20 0.37
HTR2A P28223 1/20 0.37
PMP22 Q01453 1/20 0.37
HDAC4 P56524 1/20 0.36
HDAC7 Q8WUI4 1/20 0.36
HDAC10 Q969S8 1/20 0.36
HDAC11 Q96DB2 1/20 0.36

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
SCHEMBL8768932 0.85 HDAC6 (0.50) PPARAPPARGPPARDSOAT1HDAC6
SCHEMBL8767754 0.84 PPARA (0.45) PPARAPPARGPPARDTLR7SOAT1
SCHEMBL8768890 0.83 PPARA (0.53) PPARAPPARGPPARDSOAT1HDAC6
SCHEMBL8768990 0.82 PPARA (0.50) PPARAPPARGPPARDSOAT1HDAC6
SCHEMBL8925423 0.82 PPARA (0.49) PPARAPPARGPPARDSOAT1
SCHEMBL8768903 0.82 PPARA (0.51) PPARAPPARGPPARDSOAT1HDAC6
SCHEMBL8768702 0.82 PPARA (0.44) PPARAPPARGPPARDSOAT1HDAC6
SCHEMBL9261498 0.82 HDAC6 (0.41) TLR7HDAC6HDAC1HDAC3HDAC2
SCHEMBL8768641 0.81 PPARA (0.51) PPARAPPARGPPARDSOAT1HDAC6
SCHEMBL8769015 0.81 PPARA (0.49) PPARAPPARGPPARDSOAT1HDAC6

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