Acetone

Acetone

SCHEMBL9472113

CC(C)=O.CO.ClCCl.O=CO

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.40
ALDH1A1 P00352 4/20 0.32
TDP1 Q9NUW8 2/20 0.32
CA4 P22748 2/20 0.32
TSHR P16473 1/20 0.32
TRPA1 O75762 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
Acetone SCHEMBL8359214 0.97 LMNA (0.43) LMNAALDH1A1TDP1CA4TSHR
Methylene Chloride SCHEMBL1094696 0.89
Acetic Acid SCHEMBL28675715 0.87 FFAR3 (0.47) LMNAALDH1A1TDP1CA4TSHR
Methylene Chloride SCHEMBL5045110 0.86
Acetone SCHEMBL28869975 0.86 LMNA (0.46) LMNAALDH1A1CA4TSHR
Acetone SCHEMBL7287347 0.86
Acetone SCHEMBL742461 0.86
Butanone SCHEMBL28559247 0.85 ALDH1A1 (0.56) ALDH1A1TDP1TSHRTRPA1
Acetone SCHEMBL1320683 0.82 LMNA (0.50) LMNAALDH1A1TDP1CA4TSHR
Acetone SCHEMBL2391921 0.82 LMNA (0.50) LMNAALDH1A1TDP1CA4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117482202-A Traditional Chinese medicine preparation for adjuvant therapy of leukemia and preparation method thereof 甘肃铭悦生物医药科技有限公司 2024-02-02 CN disclosed
CN-106526057-B A kind of thin-layer chromatographic analysis method for detecting flavones ingredient in serpentgrass 广东东阳光药业有限公司 2017-12-05 CN disclosed
CN-106526057-A Thin layer chromatographic analysis method for detection of flavonoids in polygonum viviparum 广东东阳光药业有限公司 2017-03-22 CN disclosed
US-5260335-A Tetragalloylquinic acid derivatives, gallic acid and methyl gallate PLANTAMED ARZNEIMITTEL GMBH (DE) 1993-11-09 US disclosed