Acetone

Acetone

SCHEMBL28847116

CC(C)=O.Oc1ccc(O)c(O)c1O

nearest known ligand 0.67

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SELL P14151 1/20 0.55
SELP P16109 1/20 0.55
HDAC1 Q13547 1/20 0.44
THRB P10828 1/20 0.43
DBH P09172 1/20 0.43
ALDH1A1 P00352 2/20 0.43
HSD17B10 Q99714 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
POLB P06746 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
ALOX12 P18054 1/20 0.43
KMT2A Q03164 1/20 0.43
KDM4C Q9H3R0 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
LMNA P02545 2/20 0.42
PIM1 P11309 1/20 0.42
ADAMTS4 O75173 1/20 0.42
EGFR P00533 1/20 0.42

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
Butanone SCHEMBL27852375 0.83 ALDH1A1 (0.53) SELLSELPHDAC1ALDH1A1HSD17B10
Ethane SCHEMBL27601092 0.82 ALDH1A1 (0.50) SELLSELPHDAC1DBHALDH1A1
Methyl Alcohol SCHEMBL28327220 0.82 ALDH1A1 (0.50) SELLSELPHDAC1DBHALDH1A1
SCHEMBL338346 0.82 ALDH1A1 (0.57) SELLSELPHDAC1THRBDBH
SCHEMBL29373601 0.82 ALDH1A1 (0.57) SELLSELPHDAC1THRBDBH
Pyrogallol SCHEMBL225781 0.81 CA1 (0.71) THRBDBHALDH1A1HSD17B10KDM4E
Gallacetophenone SCHEMBL105704 0.81 SELL (0.62) SELLSELPHDAC1ALDH1A1HSD17B10
Acetic Acid SCHEMBL2160665 0.81 SELL (0.50) SELLSELPHDAC1THRBALDH1A1
Gallacetophenone SCHEMBL29537961 0.81 SELL (0.62) SELLSELPHDAC1ALDH1A1HSD17B10
Acetone SCHEMBL29220447 0.79 TRPA1 (0.41) SELLSELPTHRBALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117982390-A Preparation method of whitening and freckle-removing cream containing plant essence composite components and hirudin 广州博科化妆品有限公司 2024-05-07 CN disclosed
CN-117398342-A Eye drop with cornea neovascularization resisting function and preparation method thereof 复旦大学附属眼耳鼻喉科医院 2024-01-16 CN disclosed
CN-116569956-A Production method of fresh-keeping eel slices 湖北省农业科学院农产品加工与核农技术研究所 2023-08-11 CN disclosed
CN-114532519-B High-sweetness stevioside composition and preparation method thereof 陕西海斯夫生物工程有限公司 2022-08-23 CN disclosed
CN-114532519-A High-sweetness stevioside composition and preparation method thereof 陕西海斯夫生物工程有限公司 2022-05-27 CN disclosed