SCHEMBL8925639

SCHEMBL8925639

CCOC(=O)C(C)(C)Oc1ccc(CCSc2cc(C)c(O)c(C)c2C)cc1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 10/20 0.48
ABCB11 O95342 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
TSHR P16473 1/20 0.48
HTR2A P28223 1/20 0.48
PMP22 Q01453 1/20 0.48
PPARG P37231 6/20 0.45
FBP1 P09467 7/20 0.41
OPRK1 P41145 1/20 0.38
PPARD Q03181 3/20 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
SCHEMBL8768129 0.88 PPARA (0.52) PPARAPPARGPPARD
SCHEMBL3341525 0.74 PPARA (0.68) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL1349983 0.72 PPARA (0.64) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL1550078 0.72 PPARA (0.64) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL13763797 0.72 PPARA (0.71) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL3286612 0.71 PPARA (0.69) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL3291229 0.71 PPARA (0.69) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL23582383 0.70 PPARA (0.61) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL3686839 0.70 PPARA (0.61) PPARAABCB11CYP1A2CYP3A4TSHR
SCHEMBL5663159 0.70 PPARA (0.61) PPARAABCB11CYP1A2CYP3A4TSHR

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
US-5627205-A ANTILIPEMIC AGENTS AND ANTIOXIDANTS ADIR ET COMPAGNIE (FR) 1997-05-06 US disclosed
US-5512595-A FOR SUPPRESSION OF MEMBRANE LIPID PEROXIDATION, ANTILIPEMIC AGENTS ADIR ET COMPAGNIE (FR) 1996-04-30 US disclosed