Acetone

Acetone

SCHEMBL8214565

CC(C)=O.CC(C)C(=O)O

nearest known ligand 0.83

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.53
LMNA P02545 2/20 0.50
FFAR3 O14843 1/20 0.46
LCK P06239 1/20 0.46
FYN P06241 1/20 0.46
SLC7A5 Q01650 1/20 0.42
TSHR P16473 2/20 0.38
ALDH1A1 P00352 2/20 0.38
THRB P10828 1/20 0.38
RECQL P46063 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
RNPEP Q9H4A4 1/20 0.36
CYP1A2 P05177 1/20 0.36

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
Acetic Acid SCHEMBL1695866 0.96 FFAR3 (0.54) TP53LMNAFFAR3LCKFYN
Acetic Acid SCHEMBL1238242 0.92 FFAR3 (0.58) TP53LMNAFFAR3LCKFYN
Acetic Acid SCHEMBL7527682 0.92 FFAR3 (0.58) TP53LMNAFFAR3LCKFYN
Acetic Acid SCHEMBL21806304 0.92 FFAR3 (0.58) TP53LMNAFFAR3LCKFYN
Acetic Acid SCHEMBL6238375 0.92 FFAR3 (0.58) TP53LMNAFFAR3LCKFYN
Acetic Acid SCHEMBL300016 0.92 FFAR3 (0.58) TP53LMNAFFAR3LCKFYN
Acetic Acid SCHEMBL10637065 0.92 FFAR3 (0.58) TP53LMNAFFAR3LCKFYN
Acetic Acid SCHEMBL10630506 0.92 FFAR3 (0.58) TP53LMNAFFAR3LCKFYN
SCHEMBL2531259 0.91 TP53 (0.61) TP53LMNAFFAR3LCKFYN
SCHEMBL2774033 0.91 TP53 (0.61) TP53LMNAFFAR3LCKFYN

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-1792474-A Ceramic sprayed member-cleaning method, program for implementing the method, storage medium storing the program, and ceramic sprayed member TOKYO ELECTRON LTD (JP) 2006-06-28 CN disclosed
WO-2000031012-A1 PROCESS FOR PRODUCTION OF AN ALLYLOXY CARBOXYLIC ACID PERSTORP AB (SE) 2000-06-02 WO disclosed
US-5886209-A CATALYTIC ESTERIFICATION OF THE CHIRALIC CARBOXYLIC ACID IN PRESENCE OF A DISTILLABLE ACID CATALYST WITH AN ALCOHOL, WITHOUT PURIFICATION OF THE BOTTOMS PRODUCT, REPEATING THE ESTERIFICATION STEP BASF AKTIENGESELLSCHAFT (DE) 1999-03-23 US disclosed