SCHEMBL4420077

SCHEMBL4420077

N#Cc1cccc(CC(ON)Oc2ccc(F)cc2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 1/20 0.40
FFAR1 O14842 2/20 0.38
FFAR4 Q5NUL3 1/20 0.38
FOLH1 Q04609 1/20 0.38
PPARG P37231 2/20 0.38
PPARA Q07869 2/20 0.38
GLA P06280 1/20 0.38
DPP4 P27487 3/20 0.38
DPP7 Q9UHL4 3/20 0.38
DPP9 Q86TI2 2/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
MAOB P27338 1/20 0.37
KCNH2 Q12809 2/20 0.36
HRH3 Q9Y5N1 1/20 0.36
NR3C1 P04150 1/20 0.36
NR3C2 P08235 1/20 0.36
MAPK14 Q16539 2/20 0.36
FAP Q12884 1/20 0.35
DPP8 Q6V1X1 1/20 0.35

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
SCHEMBL4413465 0.75 GLA (0.48) AKT1FOLH1GLADPP4DPP7
SCHEMBL4691003 0.72 DPP7 (0.43) AKT1FFAR1FFAR4FOLH1GLA
SCHEMBL4387350 0.71 FFAR1 (0.38) AKT1FFAR1FFAR4MAOBKCNH2
SCHEMBL4410263 0.70 GLA (0.40) AKT1FOLH1GLADPP4DPP7
SCHEMBL5721115 0.69 DPP4 (0.41) AKT1FFAR1FFAR4FOLH1GLA
SCHEMBL4496028 0.69 GLA (0.57) FOLH1GLADPP4DPP7DPP9
SCHEMBL5262783 0.69 GLA (0.57) FOLH1GLADPP4DPP7DPP9
SCHEMBL10606037 0.67 FOLH1 (0.50) AKT1FFAR1FFAR4FOLH1GLA
SCHEMBL22395447 0.67 FOLH1 (0.50) AKT1FFAR1FFAR4FOLH1GLA
SCHEMBL923535 0.67 ALOX5 (0.50) FFAR1FFAR4SLC6A2SLC6A4MGLL

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
EP-2040698-A2 OXIME COMPOUNDS AND THE USE THEREOF SHIONOGI & CO., LTD. (JP) 2009-04-01 EP disclosed
WO-2008008398-A2 OXIME COMPOUNDS AND THE USE THEREOF SHIONOGI & CO., LTD. (JP) 2008-01-17 WO disclosed