SCHEMBL7265017

SCHEMBL7265017

CC(OCc1ccccc1)Oc1ccc(C=CC=Cc2ccc(OC(=O)OC(C)(C)Cc3ccc(C=CO)cc3)cc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.37
PPARA Q07869 5/20 0.37
GSK3B P49841 3/20 0.34
BACE1 P56817 3/20 0.34
CTSK P43235 1/20 0.33
HTR2A P28223 1/20 0.32
SLC5A1 P13866 1/20 0.32
SLC5A2 P31639 1/20 0.32
MAOB P27338 1/20 0.32
LMNA P02545 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
MMP1 P03956 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C19 P33261 1/20 0.32
LTB4R Q15722 1/20 0.32
LTB4R2 Q9NPC1 1/20 0.32

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
SCHEMBL3838403 0.89 CYP3A4 (0.33) PPARGPPARACTSKHTR2AMAOB
SCHEMBL6552052 0.88 CYP3A4 (0.35) PPARGPPARACTSKHTR2ALMNA
SCHEMBL7269887 0.87 PPARG (0.40) PPARGPPARAGSK3BBACE1SLC5A1
SCHEMBL6871784 0.83 PPARG (0.32) PPARGPPARAMAOB
SCHEMBL4968047 0.80 CTSK (0.33) PPARGPPARACTSKLMNACYP1A2
SCHEMBL3844773 0.80 ACACB (0.32) PPARGPPARALMNACYP1A2CYP2C19
SCHEMBL5454889 0.80 CTSK (0.36) CTSKLMNACYP1A2CYP2C19
SCHEMBL7269894 0.79 PPARG (0.39) PPARGPPARAGSK3BBACE1SLC5A1
SCHEMBL6278092 0.77 KDM4E (0.36) PPARGPPARACTSKMAOB
SCHEMBL6551673 0.77 PPARG (0.35) PPARGPPARAGSK3BCTSKLMNA

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-6656660-B1 Resist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-12-02 US disclosed
EP-1024406-A1 Resist composition WAKO PURE CHEMICAL INDUSTRIES LTD (JP) 2000-08-02 EP disclosed