Acetophenone

Acetophenone

SCHEMBL28513709

CC(=O)c1ccccc1.CCCCCOC(=O)O

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.56
TP53 P04637 1/20 0.56
CYP3A4 P08684 1/20 0.56
MAPK1 P28482 1/20 0.56
LMNA P02545 5/20 0.54
ALDH1A1 P00352 2/20 0.54
TDP1 Q9NUW8 2/20 0.53
RAB9A P51151 3/20 0.51
HPGD P15428 1/20 0.51
CNR2 P34972 1/20 0.50
L3MBTL1 Q9Y468 2/20 0.49
KDM4E B2RXH2 1/20 0.48
POLB P06746 1/20 0.48
HSD17B10 Q99714 1/20 0.48
CES2 O00748 1/20 0.47
CES1 P23141 1/20 0.47
PPARG P37231 3/20 0.47
NPC1 O15118 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MAPT P10636 1/20 0.46

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
Acetophenone SCHEMBL28515793 0.98 LMNA (0.57) TSHRTP53CYP3A4MAPK1LMNA
Acetophenone SCHEMBL28262081 0.98 LMNA (0.57) TSHRTP53CYP3A4MAPK1LMNA
Acetophenone SCHEMBL28519002 0.95 LMNA (0.56) TSHRTP53CYP3A4MAPK1LMNA
Acetophenone SCHEMBL28079102 0.90 TSHR (0.56) TSHRTP53CYP3A4MAPK1LMNA
Acetophenone SCHEMBL28262080 0.89 LMNA (0.57) TSHRTP53CYP3A4MAPK1LMNA
Acetophenone SCHEMBL28521014 0.88 LMNA (0.65) TSHRLMNAALDH1A1TDP1RAB9A
Acetophenone SCHEMBL28186100 0.86 CES2 (0.60) LMNAALDH1A1HPGDCES2CES1
Propiophenone SCHEMBL28519981 0.85 TSHR (0.54) TSHRTP53CYP3A4MAPK1LMNA
Acetophenone SCHEMBL27577933 0.85 ALDH1A1 (0.62) TSHRTP53CYP3A4MAPK1LMNA
Acetophenone SCHEMBL27486761 0.84 ALDH1A1 (0.79) TSHRTP53CYP3A4MAPK1LMNA

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
CN-109111537-B Catalyst component for olefin polymerization and catalyst thereof 中国石油化工股份有限公司 2021-03-16 CN disclosed
CN-109111539-B Catalyst component for olefin polymerization and catalyst thereof 中国石油化工股份有限公司 2021-02-05 CN disclosed
CN-109111538-B Catalyst component for olefin polymerization and catalyst thereof 中国石油化工股份有限公司 2021-02-05 CN disclosed