SCHEMBL8924711

SCHEMBL8924711

CC(C)(Oc1ccc(Cl)c(CCSc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)c1)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 17/20 0.41
MEN1 O00255 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
MAPT P10636 1/20 0.41
CYP2C19 P33261 1/20 0.41
KMT2A Q03164 1/20 0.41
PPARD Q03181 11/20 0.39
PPARG P37231 11/20 0.39
FABP2 P12104 1/20 0.38
SLC22A12 Q96S37 1/20 0.38
PTPN7 P35236 1/20 0.37
DUSP3 P51452 1/20 0.37
PTPN12 Q05209 1/20 0.37
PTPN22 Q9Y2R2 1/20 0.37
VCAM1 P19320 1/20 0.36
LMNA P02545 1/20 0.36
CYP2C9 P11712 1/20 0.36
TSHR P16473 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
SCHEMBL8768773 0.83 PPARA (0.54) PPARAPPARDPPARG
Tert-Butylamine SCHEMBL8924413 0.82 PPARA (0.45) PPARAMEN1CYP1A2CYP3A4CYP2D6
SCHEMBL8767310 0.80 PPARA (0.47) PPARAPPARDPPARG
SCHEMBL8767430 0.79 PPARA (0.56) PPARAPPARDPPARG
SCHEMBL8923383 0.77 PPARA (0.54) PPARAPPARDPPARG
Tert-Butylamine SCHEMBL8924062 0.77 PPARA (0.45) PPARAPPARDPPARG
SCHEMBL8767800 0.76 PPARA (0.52) PPARAMEN1CYP1A2CYP3A4CYP2D6
SCHEMBL8923438 0.74 PPARA (0.44) PPARAMEN1CYP1A2CYP3A4CYP2D6
SCHEMBL8924642 0.73 ADRB3 (0.43) PPARAMEN1CYP1A2CYP3A4CYP2D6
SCHEMBL8924650 0.73 ADRB3 (0.43) PPARAMEN1CYP1A2CYP3A4CYP2D6

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