4-(Acetate)Acetophenone

4-(Acetate)Acetophenone

SCHEMBL9065455

CC(=O)Oc1ccc(C(C)=O)cc1.CCOC(C)OCC

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 3/20 0.49
HSD17B10 Q99714 1/20 0.47
MAPT P10636 4/20 0.47
HPGD P15428 1/20 0.47
RAB9A P51151 1/20 0.47
KMT2A Q03164 6/20 0.47
LMNA P02545 2/20 0.46
POLB P06746 2/20 0.46
NPSR1 Q6W5P4 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
GAA P10253 1/20 0.45
MEN1 O00255 1/20 0.43
ESR1 P03372 1/20 0.43
PGR P06401 1/20 0.43
CHRM2 P08172 1/20 0.43
ADORA3 P0DMS8 1/20 0.43
AR P10275 1/20 0.43
CHRM1 P11229 1/20 0.43
SLC6A2 P23975 1/20 0.43
SLC6A3 Q01959 1/20 0.43

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
SCHEMBL810801 0.83 MAPT (0.50) MAPTHPGDRAB9AKMT2ALMNA
4-(Acetate)Acetophenone SCHEMBL1142839 0.82 MAPT (0.67) ELANEHSD17B10MAPTHPGDRAB9A
4-(Acetate)Acetophenone SCHEMBL28047084 0.80 ELANE (0.64) ELANEHSD17B10MAPTHPGDRAB9A
Acetophenone SCHEMBL6684394 0.80 LMNA (0.47) MAPTHPGDRAB9AKMT2ALMNA
SCHEMBL2691203 0.78 ELANE (0.53) ELANEHSD17B10MAPTHPGDRAB9A
Ethylene SCHEMBL8144692 0.77 LMNA (0.39) MAPTHPGDRAB9AKMT2ALMNA
Ethylene SCHEMBL9411120 0.77 MAOB (0.49) MAPTHPGDRAB9AKMT2ALMNA
Ethylene SCHEMBL9049073 0.77 LMNA (0.39) MAPTHPGDRAB9AKMT2ALMNA
SCHEMBL9330819 0.77 HSD17B10 (0.75) ELANEHSD17B10MAPTHPGDRAB9A
Acetophenone SCHEMBL9387329 0.77 CES2 (0.44) MAPTHPGDKMT2ALMNAL3MBTL1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1996035829-A1 PROCESS FOR THE ELECTROCHEMICAL OXIDATION OF ARYLKETONES HOECHST CELANESE CORPORATION (US) 1996-11-14 WO disclosed
US-5567299-A Process for the electrochemical oxidation of arylketones HOECHST CELANESE CORPORATION (US) 1996-10-22 US disclosed
US-5500099-A Process for the electrochemical oxidation of arylketones HOECHST CELANESE CORPORATION (US) 1996-03-19 US disclosed