Ethyl Acetate

Ethyl Acetate

SCHEMBL9724261

CCOC(C)=O.Cc1ccc(C(=O)c2ccc(CC(N)=O)n2C)cc1

nearest known ligand 0.62

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCL8 P10145 1/20 0.62
AKR1B1 P15121 1/20 0.62
PTGS1 P23219 1/20 0.62
PTGS2 P35354 1/20 0.62
GLO1 Q04760 1/20 0.62
HPGD P15428 2/20 0.60
ALDH1A1 P00352 6/20 0.36
RAB9A P51151 2/20 0.36
LMNA P02545 3/20 0.36
MAPT P10636 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
KDM4E B2RXH2 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HSD17B10 Q99714 1/20 0.34
ALOX15 P16050 1/20 0.34
BDKRB2 P30411 2/20 0.34
KMT2A Q03164 2/20 0.33
NOD2 Q9HC29 1/20 0.33
NOD1 Q9Y239 1/20 0.33
MEN1 O00255 1/20 0.33

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
SCHEMBL9724249 0.90 PTGS2 (0.76) CXCL8AKR1B1PTGS1PTGS2GLO1
SCHEMBL11877048 0.83 CXCL8 (0.70) CXCL8AKR1B1PTGS1PTGS2GLO1
SCHEMBL12608965 0.80 PTGS2 (0.78) CXCL8AKR1B1PTGS1PTGS2GLO1
SCHEMBL2238865 0.78 PTGS2 (0.57) CXCL8AKR1B1PTGS1PTGS2GLO1
Tolmetin SCHEMBL28723181 0.78 PTGS2 (0.94) CXCL8AKR1B1PTGS1PTGS2GLO1
SCHEMBL13653108 0.78 PTGS2 (0.74) CXCL8AKR1B1PTGS1PTGS2GLO1
Tolmetin SCHEMBL3150 0.77 PTGS2 (1.00) CXCL8AKR1B1PTGS1PTGS2GLO1
Tolmetin SCHEMBL11325188 0.77 PTGS2 (1.00) CXCL8AKR1B1PTGS1PTGS2GLO1
SCHEMBL11807843 0.77 CXCL8 (0.60) CXCL8AKR1B1PTGS1PTGS2GLO1
SCHEMBL13241359 0.77 CXCL8 (0.72) CXCL8AKR1B1PTGS1PTGS2GLO1

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
JP-4210963-A None JP disclosed
JP-H04210963-A PYRROLACETIC AMIDE SIGMA TAU IND FARMACEUT RIUNITE SPA 1992-08-03 JP disclosed