SCHEMBL7270952

SCHEMBL7270952

CC(C)(C)OCCOc1ccc(C=CC=Cc2ccc(O)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 2/20 0.50
CHRNB4 P30926 2/20 0.50
CHRNA3 P32297 2/20 0.50
CHRNA7 P36544 2/20 0.50
CHRNA4 P43681 2/20 0.50
APP P05067 1/20 0.47
ABCG2 Q9UNQ0 3/20 0.47
STAT3 P40763 1/20 0.43
MAOB P27338 1/20 0.43
LTA4H P09960 3/20 0.42
NR5A1 Q13285 1/20 0.42
PPARA Q07869 3/20 0.42
PTGS2 P35354 2/20 0.41
PTGS1 P23219 1/20 0.41
TTR P02766 1/20 0.41
CYP1A1 P04798 1/20 0.41
ALOX5 P09917 1/20 0.41
CYP1B1 Q16678 1/20 0.41

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
SCHEMBL10053670 0.81 ALDH1A1 (0.48) CHRNB4CHRNA3CHRNA7APPPPARA
SCHEMBL7702904 0.80 APP (0.55) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL5679443 0.78 ABCG2 (0.59) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL3329743 0.77 APP (0.57) APPSTAT3MAOBLTA4HPTGS2
SCHEMBL8517895 0.77 APP (0.48) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL25607237 0.76 APP (0.63) APP
SCHEMBL6569297 0.76 CHRNA7 (0.54) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL2964490 0.75 MEN1 (0.49) APPABCG2STAT3MAOBPTGS2
SCHEMBL8661728 0.74 ABCG2 (0.55) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL8755230 0.74 APP (0.48) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4

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