SCHEMBL7269887

SCHEMBL7269887

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

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARG P37231 8/20 0.40
PPARA Q07869 7/20 0.40
CYP1A1 P04798 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP19A1 P11511 1/20 0.35
LCK P06239 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GSK3B P49841 2/20 0.33
BACE1 P56817 2/20 0.33
MAOB P27338 2/20 0.31
SLC5A1 P13866 1/20 0.31
SLC5A2 P31639 1/20 0.31
LMNA P02545 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL7269894 0.88 PPARG (0.39) PPARGPPARACYP1A1CYP1A2CYP19A1
SCHEMBL3842762 0.87 PPARG (0.33) PPARGPPARA
SCHEMBL7265017 0.87 PPARG (0.37) PPARGPPARACYP1A2NPC1RAB9A
SCHEMBL6278797 0.86 PPARG (0.34) PPARGPPARA
SCHEMBL7264956 0.85 PPARG (0.34) PPARGPPARA
SCHEMBL6551779 0.84 PPARG (0.44) PPARGPPARACYP1A1CYP1A2CYP19A1
SCHEMBL5145553 0.80 CYP1A2 (0.50) PPARGPPARACYP1A1CYP1A2CYP19A1
SCHEMBL7263292 0.79 PPARG (0.33) PPARGPPARA
SCHEMBL3837628 0.78 PPARG (0.30) PPARGPPARA
SCHEMBL4966706 0.78 PPARG (0.32) PPARGPPARA

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