Acetophenone

Acetophenone

SCHEMBL8930041

CC(=O)CCC(C)C.CC(=O)c1ccccc1

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
MAPT P10636 4/20 0.47
ALDH1A1 P00352 3/20 0.46
HPGD P15428 2/20 0.43
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
HTT P42858 2/20 0.41
MAOB P27338 1/20 0.41
MAPK1 P28482 1/20 0.41
ATM Q13315 1/20 0.41
TRPA1 O75762 1/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
KMT2A Q03164 2/20 0.41
TAAR1 Q96RJ0 1/20 0.41
P2RX7 Q99572 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
APOBEC3A P31941 1/20 0.40
APOBEC3G Q9HC16 1/20 0.40

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 SCHEMBL4730064 0.84 SMN1; SMN2 (0.58) LMNASMN1; SMN2MAPTALDH1A1HPGD
Acetophenone SCHEMBL3652265 0.81 ALDH1A1 (0.56) LMNASMN1; SMN2MAPTALDH1A1HPGD
Acetophenone SCHEMBL27269538 0.80 SMN1; SMN2 (0.54) LMNASMN1; SMN2MAPTALDH1A1HPGD
Hydrogen Peroxide SCHEMBL6884370 0.79 CA1 (0.55) LMNAALDH1A1TRPA1
SCHEMBL725762 0.79 TRPA1 (0.58) LMNASMN1; SMN2MAPTALDH1A1HPGD
Benzene SCHEMBL27311002 0.79 TRPA1 (0.58) LMNASMN1; SMN2MAPTALDH1A1HPGD
Acetophenone SCHEMBL10608667 0.78 MAPT (0.60) LMNASMN1; SMN2MAPTALDH1A1HPGD
Acetophenone SCHEMBL28762993 0.78 MAPT (0.60) LMNASMN1; SMN2MAPTALDH1A1HPGD
Acetic Acid SCHEMBL4601895 0.77 CA1 (0.52) LMNAALDH1A1TRPA1
Acetophenone SCHEMBL7259513 0.77 SMN1; SMN2 (0.50) LMNASMN1; SMN2MAPTALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5612303-A HYDROXY OR ETHERIFIED ESTERS NITTO CHEMICAL INDUSTRY CO., LTD. (JP) 1997-03-18 US claimed