Acetone

Acetone

SCHEMBL3494828

CC(C)=O.O=C1OC2(OC=C(c3ccccc3)C2=O)c2ccccc21

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 8/20 0.40
GAA P10253 1/20 0.39
PKM P14618 1/20 0.39
CFTR P13569 1/20 0.39
GOPC Q9HD26 1/20 0.39
DRD2 P14416 4/20 0.38
MAPT P10636 4/20 0.37
ALDH1A1 P00352 3/20 0.37
ITGA4 P13612 1/20 0.37
HSP90AA1 P07900 2/20 0.36
HSP90AB1 P08238 1/20 0.36
KMT2A Q03164 3/20 0.36
KDM4E B2RXH2 1/20 0.36
APAF1 O14727 1/20 0.36
TDP2 O95551 1/20 0.36
NSD2 O96028 1/20 0.36
RECQL P46063 1/20 0.36
SAE1 Q9UBE0 1/20 0.36
UBA2 Q9UBT2 1/20 0.36
GRIN2D O15399 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
Methyl Alcohol SCHEMBL27955397 0.94 SIGMAR1 (0.42) SIGMAR1GAAPKMCFTRGOPC
SCHEMBL29390919 0.93 CFTR (0.44) SIGMAR1GAAPKMCFTRGOPC
SCHEMBL37303 0.93 CFTR (0.44) SIGMAR1GAAPKMCFTRGOPC
SCHEMBL6341038 0.93 CFTR (0.44) SIGMAR1GAAPKMCFTRGOPC
Ammonia Solution, Strong SCHEMBL13731210 0.92 CFTR (0.42) SIGMAR1GAAPKMCFTRGOPC
Alcohol SCHEMBL6307137 0.91 SIGMAR1 (0.42) SIGMAR1GAAPKMCFTRGOPC
Isothiocyanate SCHEMBL16059997 0.85 CFTR (0.38) SIGMAR1GAAPKMCFTRGOPC
SCHEMBL11314758 0.83 PTPRC (0.39) SIGMAR1GAAPKMCFTRGOPC
SCHEMBL11312792 0.82 ALDH1A1 (0.39) SIGMAR1CFTRGOPCDRD2MAPT
Allylamine SCHEMBL11236327 0.82 SIGMAR1 (0.42) SIGMAR1GAAPKMCFTRGOPC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116818958-B Method for measuring content of 5-aminolevulinic acid and glycine in fermentation broth 北京挑战生物技术有限公司 2023-11-21 CN claimed
CN-116818958-A Method for measuring content of 5-aminolevulinic acid and glycine in fermentation broth 北京挑战生物技术有限公司 2023-09-29 CN claimed
CN-116818958-B Method for measuring content of 5-aminolevulinic acid and glycine in fermentation broth 北京挑战生物技术有限公司 2023-11-21 CN disclosed
CN-116818958-A Method for measuring content of 5-aminolevulinic acid and glycine in fermentation broth 北京挑战生物技术有限公司 2023-09-29 CN disclosed
CN-116333217-B Preparation method of amino-containing polymer, polymer product and application 上海微密医疗科技有限公司 2023-08-15 CN disclosed
CN-116333217-A Preparation method of amino-containing polymer, polymer product and application 上海微密医疗科技有限公司 2023-06-27 CN disclosed
CN-115843246-A Methods and compositions for treating hemangiomas 吉利斯麦金德研究院 2023-03-24 CN disclosed
CN-110261358-B Method for measuring content of primary amine group in gelatin 齐鲁工业大学 2021-07-23 CN disclosed
CN-107753953-B Preparation of PEGylated kininogenase and application thereof 江苏众红生物工程创药研究院有限公司 2021-06-08 CN disclosed
CN-108267590-B PEG (polyethylene glycol) combination number detection method of PEG modified protein 江苏众红生物工程创药研究院有限公司 2021-05-11 CN disclosed
CN-107760661-B PEG modifier of medicinal kininogenase and preparation method and application thereof 江苏众红生物工程创药研究院有限公司 2020-10-27 CN disclosed
CN-108226114-A The assay method of 4- aminoazabenzols that azo dyes releases in a kind of paper material 上海烟草集团有限责任公司 2018-06-29 CN disclosed
CN-108181278-A The assay method for the aromatic amine that azo dyes releases in a kind of paper material 上海烟草集团有限责任公司 2018-06-19 CN disclosed
US-9155702-B2 Composition and microsphere for controlled-release of exendin, and method preparing the same PEPTRON CO., LTD (KR) 2015-10-13 US disclosed
EP-2134329-B1 COMPOSITION AND MICROSPHERE FOR CONTROLLED-RELEASE OF EXENDIN, AND METHOD OF PREPARING THE SAME PEPTRON CO LTD (KR) 2015-01-07 EP disclosed
CN-102879370-A Fluorescence method for determining Sulfamethoxazole and Danofloxacin in milk simultaneously UNIV JIANGNAN 2013-01-16 CN disclosed
US-20100136126-A1 COMPOSITION AND MICROSPHERE FOR CONTROLLED-RELEASE OF EXENDIN, AND METHOD OF PREPARING THE SAME PEPTRON CO., LTD (KR) 2010-06-03 US disclosed
EP-2134329-A1 COMPOSITION AND MICROSPHERE FOR CONTROLLED-RELEASE OF EXENDIN, AND METHOD OF PREPARING THE SAME Peptron Co., Ltd. (KR) 2009-12-23 EP disclosed
WO-2008117927-A1 COMPOSITION AND MICROSPHERE FOR CONTROLLED-RELEASE OF EXENDIN, AND METHOD OF PREPARING THE SAME PEPTRON CO., LTD (KR) 2008-10-02 WO disclosed
US-5079167-A Enzymatic resolution of amino acid carbamate racemates GESELLSCHAFT FUR BIOTECHNOLOGISCHE FORSCHUNG MBH (GBF) (DE) 1992-01-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100136126-A1 COMPOSITION AND MICROSPHERE FOR CONTROLLED-RELEASE OF EXENDIN, AND METHOD OF PREPARING THE SAME NPY1R, MLN, NPY5R SIGMAR1 1956/4885GAA 2434/4885PKM 2718/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.