Acetone

Acetone

SCHEMBL561689

CC(C)=O.CN(C)c1cccc2c(S(=O)(=O)Cl)cccc12

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.61
F2 P00734 3/20 0.56
PRSS1 P07477 3/20 0.56
PRSS2 P07478 3/20 0.56
PRSS3 P35030 3/20 0.56
CYP1A2 P05177 1/20 0.55
CYP2C19 P33261 1/20 0.55
HTT P42858 1/20 0.55
HIF1A Q16665 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
KMT2A Q03164 1/20 0.52
ATM Q13315 1/20 0.52
EDNRA P25101 8/20 0.52
HDAC4 P56524 1/20 0.47
HDAC10 Q969S8 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
HDAC5 Q9UQL6 1/20 0.47
KDM4E B2RXH2 1/20 0.47
NSD2 O96028 1/20 0.47

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
Bicarbonate SCHEMBL28267246 0.94 CA2 (0.61) CA2F2PRSS1PRSS2PRSS3
SCHEMBL21283 0.93 CA2 (0.69) CA2F2PRSS1PRSS2PRSS3
SCHEMBL30362953 0.93 CA2 (0.69) CA2F2PRSS1PRSS2PRSS3
SCHEMBL29429225 0.93 CA2 (0.69) CA2F2PRSS1PRSS2PRSS3
SCHEMBL10344363 0.93 CA2 (0.69) CA2F2PRSS1PRSS2PRSS3
SCHEMBL31040675 0.92 CA2 (0.67) CA2F2PRSS1PRSS2PRSS3
SCHEMBL28444883 0.92 CA2 (0.67) CA2F2PRSS1PRSS2PRSS3
Hydrochloric Acid SCHEMBL27789615 0.92 CA2 (0.67) CA2F2PRSS1PRSS2PRSS3
Methylene Chloride SCHEMBL28518212 0.89 CA2 (0.63) CA2F2PRSS1PRSS2PRSS3
Acetonitrile SCHEMBL8500753 0.86 CA2 (0.59) CA2F2PRSS1PRSS2PRSS3

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 83 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117805304-A Method and kit for detecting hormone in blood sample 中国环境科学研究院 2024-04-02 CN claimed
CN-117647604-A Method for measuring content of hexamethylenediamine in nylon-66 material by high performance liquid chromatography 广东美捷时控股股份有限公司 2024-03-05 CN claimed
CN-116183757-B Method for measuring residual quantity of cyanamide in grape wine 秦皇岛海关技术中心 2023-09-12 CN claimed
CN-116183757-A Method for measuring residual quantity of cyanamide in grape wine 秦皇岛海关技术中心 2023-05-30 CN claimed
CN-107462646-B Method for detecting residual quantity of cyanamide in fruit 山东省烟台市农业科学研究院 2020-04-10 CN claimed
CN-110699417-A Detection method for amino acid decarboxylation capability of fish putrefying bacteria 中国农业大学 2020-01-17 CN claimed
CN-106645476-B A kind of remaining method of detection sec-butylamine and application 青岛海润检测股份有限公司 2018-11-06 CN claimed
CN-117305162-B CMU-Pb-L5 and application thereof in preparation of colorectal cancer treatment drugs 广东行海生物科技有限公司 2024-07-12 CN disclosed
CN-116254253-B Glutamic acid decarboxylase mutant obtained through DNA synthesis shuffling combination mutation and application 浙大宁波理工学院 2024-06-28 CN disclosed
CN-118243673-A Mixed SERS sensor based on 'biological silence area' label and method for simultaneously detecting histamine, tyramine and phenethylamine in food 山东农业大学 2024-06-25 CN disclosed
CN-118185844-A High-yield bacterial strain of hexamethylenediamine and preparation method thereof 淮北矿业绿色化工新材料研究院有限公司 2024-06-14 CN disclosed
CN-117987481-A 1, 6-Hexamethylenediamine fermentation production method based on recombinant bacteria 淮北矿业绿色化工新材料研究院有限公司 2024-05-07 CN disclosed
CN-117947120-A Biosynthesis method of 1, 6-hexamethylenediamine 淮北矿业绿色化工新材料研究院有限公司 2024-04-30 CN disclosed
US-7446242-B2 Plants with improved morphogenesis and method of constructing the same TOYO BOSEKI KABUSHIKI KAISHA (JP) 2008-11-04 US disclosed
CN-100389200-C Plants with improved morphogenesis and methods of making the same TOYOBO RES CT CO LTD (JP) 2008-05-21 CN disclosed
US-20060225154-A1 Method for increasing expression of stress defense genes TOYO BOSEKI KABUSHIKI KAISHA (JP) 2006-10-05 US disclosed
US-20050150015-A1 Plants with improved morphogenesis and method of constructing the same TOYO BOSEKI KABUSHIKI KAISHA (JP) 2005-07-07 US disclosed
EP-1498027-A1 PLANT WITH IMPROVED ORGANOGENESIS AND METHOD OF CONSTRUCTING THE SAME Toyobo Research Center Co., LTD. (JP) 2005-01-19 EP disclosed
US-4745101-A ANTICARIES AGENTS TEIKOKU HORMONE MFG. CO., LTD. (JP) 1988-05-17 US disclosed
EP-0203359-A2 Novel peptide having dentinal fluid transport stimulating activity TEIKOKU HORMONE MFG. CO., LTD. (JP) 1986-12-03 EP disclosed