SCHEMBL288495

SCHEMBL288495

CC(O)CC(=O)OC(CC(=O)[O-])C[N+](C)(C)C

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.71
KMT2A Q03164 4/20 0.71
CYP2C19 P33261 2/20 0.71
RECQL P46063 1/20 0.71
CYP1A2 P05177 3/20 0.65
HRH1 P35367 1/20 0.65
SLC25A20 O43772 3/20 0.60
TP53 P04637 3/20 0.60
TSHR P16473 3/20 0.60
CYP2D6 P10635 2/20 0.60
SLC6A5 Q9Y345 2/20 0.60
MAPT P10636 2/20 0.60
CYP2C9 P11712 2/20 0.60
HIF1A Q16665 2/20 0.60
KDM4E B2RXH2 1/20 0.60
CYP3A4 P08684 1/20 0.60
NFKB1 P19838 1/20 0.60
THPO P40225 1/20 0.60
HSD17B10 Q99714 1/20 0.60
SLC22A16 Q86VW1 1/20 0.52

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
SCHEMBL31011113 1.00 MEN1 (0.71) MEN1KMT2ACYP2C19RECQLCYP1A2
SCHEMBL30513874 1.00 MEN1 (0.71) MEN1KMT2ACYP2C19RECQLCYP1A2
Carnitine SCHEMBL994915 0.95 MEN1 (0.65) MEN1KMT2ACYP2C19RECQLCYP1A2
SCHEMBL994842 0.89 MEN1 (0.57) MEN1KMT2ACYP2C19RECQLCYP1A2
SCHEMBL464880 0.88 MEN1 (0.73) MEN1KMT2ACYP2C19RECQLCYP1A2
SCHEMBL16238330 0.88 MEN1 (0.73) MEN1KMT2ACYP2C19RECQLCYP1A2
SCHEMBL232682 0.88 MEN1 (0.73) MEN1KMT2ACYP2C19RECQLCYP1A2
Hydrochloric Acid SCHEMBL9465317 0.87 MEN1 (0.71) MEN1KMT2ACYP2C19RECQLCYP1A2
SCHEMBL4962977 0.86 MEN1 (0.75) MEN1KMT2ACYP2C19RECQLCYP1A2
SCHEMBL4962982 0.86 MEN1 (0.75) MEN1KMT2ACYP2C19RECQLCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4720665-A1 METHOD OF DIAGNOSIS AND TREATMENT OF ALZHEIMER'S DISEASE Molecular You Corporation (CA) 2026-04-08 EP claimed
CN-120195296-A Combined metabolic marker for judging insulin resistance risk of high-fat diet mice exposed to bisphenol S in perinatal period of female mice and detection kit thereof 集美大学 2025-06-24 CN claimed
CN-119322179-A Application of biomarker in predicting diabetes strengthening treatment effect and kit 中日友好医院(中日友好临床医学研究所) 2025-01-17 CN claimed
US-20240426830-A1 CHRONIC WOUND HEALING BIOMARKER DIAGNOSTICS THE TRUSTEES OF INDIANA UNIVERSITY 2024-12-26 US claimed
WO-2024239122-A1 METHOD OF DIAGNOSIS AND TREATMENT OF ALZHEIMER'S DISEASE Molecular You Corporation (CA) 2024-11-28 WO claimed
CN-118067976-A Application of metabolic markers in preparation of products for predicting or prognosis evaluation of diabetes curative effect 首都医科大学附属北京友谊医院 2024-05-24 CN claimed
CN-118033023-A Lung cancer biomarker and application thereof 中山大学肿瘤防治中心(中山大学附属肿瘤医院、中山大学肿瘤研究所) 2024-05-14 CN claimed
CN-117074589-A Method for detecting succinylacetone, amino acid and carnitine in maternal amniotic fluid 山东英盛生物技术有限公司 2023-11-17 CN claimed
US-20230324349-A1 ACYLCARNITINE ANALYSIS METHOD AND ACYLCARNITINE ANALYSIS DEVICE SHIMADZU CORPORATION (JP) 2023-10-12 US claimed
CN-116804677-A Biomarker for early detection of aspiration pneumonia and application thereof 福建医科大学附属第二医院 2023-09-26 CN claimed
WO-2013060788-A2 METHOD AND USE OF METABOLITES FOR THE DIAGNOSIS AND DIFFERENTIATION OF NEONATAL ENCEPHALOPATHY INFANDX AG (DE) 2013-05-02 WO claimed
EP-2587264-A1 Method and use of metabolites for the diagnosis and differentiation of neonatal encephalopathy InfanDx AG (DE) 2013-05-01 EP claimed
US-20120208282-A1 Method For Normalization in Metabolomics Analysis Methods with Endogenous Reference Metabolites. BIOCRATES LIFE SCIENCES AG 2012-08-16 US claimed
US-20120136581-A1 Method of Diagnosing Asphyxia BIOCRATES LIFE SCIENCES AG (AT) 2012-05-31 US claimed
EP-2449488-A1 METHOD FOR NORMALIZATION IN METABOLOMICS ANALYSIS METHODS WITH ENDOGENOUS REFERENCE METABOLITES BIOCRATES Life Sciences AG (AT) 2012-05-09 EP claimed
EP-2427773-A1 METHOD OF DIAGNOSING ASPHYXIA Keller, Matthias (DE) 2012-03-14 EP claimed
WO-2011000753-A1 METHOD FOR NORMALIZATION IN METABOLOMICS ANALYSIS METHODS WITH ENDOGENOUS REFERENCE METABOLITES BIOCRATES LIFE SCIENCES AG (AT) 2011-01-06 WO claimed
EP-2270699-A1 Method for normalization in metabolomics analysis methods with endogenous reference metabolites BIOCRATES Life Sciences AG (AT) 2011-01-05 EP claimed
WO-2010128054-A1 METHOD OF DIAGNOSING ASPHYXIA BIOCRATES LIFE SCIENCES AG (AT) 2010-11-11 WO claimed
EP-2249161-A1 Method of diagnosing asphyxia BIOCRATES Life Sciences AG (AT) 2010-11-10 EP claimed