SCHEMBL1208087

SCHEMBL1208087

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

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.71
KMT2A Q03164 3/20 0.71
CYP1A2 P05177 1/20 0.71
HRH1 P35367 1/20 0.71
CYP2C19 P33261 2/20 0.67
RECQL P46063 1/20 0.67
SLC22A16 Q86VW1 1/20 0.61
CPT2 P23786 2/20 0.57
CPT1A P50416 2/20 0.57
SLC25A20 O43772 3/20 0.56
TP53 P04637 2/20 0.56
CYP2D6 P10635 2/20 0.56
TSHR P16473 2/20 0.56
SLC6A5 Q9Y345 2/20 0.56
KDM4E B2RXH2 1/20 0.56
CYP3A4 P08684 1/20 0.56
MAPT P10636 1/20 0.56
CYP2C9 P11712 1/20 0.56
NFKB1 P19838 1/20 0.56
THPO P40225 1/20 0.56

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
SCHEMBL4256715 1.00 MEN1 (0.71) MEN1KMT2ACYP1A2HRH1CYP2C19
SCHEMBL17629809 1.00 MEN1 (0.71) MEN1KMT2ACYP1A2HRH1CYP2C19
SCHEMBL8767045 0.92 MEN1 (0.62) MEN1KMT2ACYP1A2HRH1CYP2C19
SCHEMBL26797580 0.92 MEN1 (0.62) MEN1KMT2ACYP1A2HRH1CYP2C19
SCHEMBL26797583 0.92 MEN1 (0.62) MEN1KMT2ACYP1A2HRH1CYP2C19
Cadaverine Tartrate SCHEMBL7526527 0.89 MEN1 (0.59) MEN1KMT2ACYP1A2HRH1CYP2C19
SCHEMBL1830071 0.87 MEN1 (0.57) MEN1KMT2ACYP1A2HRH1CYP2C19
SCHEMBL28171779 0.87 MEN1 (0.67) MEN1KMT2ACYP1A2HRH1CYP2C19
SCHEMBL7031982 0.87 MEN1 (0.67) MEN1KMT2ACYP1A2HRH1CYP2C19
SCHEMBL2994007 0.85 MEN1 (0.65) MEN1KMT2ACYP1A2HRH1CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101317817-A External slimming coating agent ZHONGHUA YUAN (CN) 2008-12-10 CN claimed
WO-2024058984-A2 METHODS AND USES OF MICROBIOME COMPOSITIONS, COMPONENTS, OR METABOLITES FOR TREATING INSULIN-ASSOCIATED DISEASES MarvelBiome, Inc. (US) 2024-03-21 WO disclosed
WO-2023038450-A1 PHARMACEUTICAL COMPOSITION COMPRISING LARGE PHYSIOLOGICALLY ACTIVE SUBSTANCE AND EXCIPIENT (주)디앤디파마텍 2023-03-16 WO disclosed
EP-3694646-A1 A STREAMLINED METHOD FOR ANALYTICAL VALIDATION OF BIOCHEMICALS DETECTED USING AN UNTARGETED MASS-SPECTROMETRY PLATFORM Metabolon, Inc. (US) 2020-08-19 EP disclosed
WO-2019074757-A1 A STREAMLINED METHOD FOR ANALYTICAL VALIDATION OF BIOCHEMICALS DETECTED USING AN UNTARGETED MASS-SPECTROMETRY PLATFORM METABOLON, INC. (US) 2019-04-18 WO disclosed
US-20180064154-A9 MANAGEMENT OF PROPIONATE METABOLISM DISORDERS MORTON D HOLMES (US) 2018-03-08 US disclosed
US-9662344-B2 Carnitine retention THE UNIVERSITY OF NOTTINGHAM (GB) 2017-05-30 US disclosed
US-20170055562-A1 MANAGEMENT OF PROPIONATE METABOLISM DISORDERS MORTON D HOLMES (US) 2017-03-02 US disclosed
EP-3094968-A1 METABOLIC SCREENING FOR GESTATIONAL DIABETES The Regents of The University of California (US) 2016-11-23 EP disclosed
WO-2015109116-A1 METABOLIC SCREENING FOR GESTATIONAL DIABETES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2015-07-23 WO disclosed
WO-2004082674-A1 CARNITINE RETENTION THE UNIVERSITY OF NOTTINGHAM (GB) 2004-09-30 WO disclosed
US-20040058947-A1 Composition for the prevention or treatment of learning disorders in children suffering from attention deficit/hyperactive disorder SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2004-03-25 US disclosed
CN-1447680-A Local release system of micronutrients and application thereof NIADYNE CORP (US) 2003-10-08 CN disclosed
EP-1272157-A2 TOPICAL MICRONUTRIENT DELIVERY SYSTEM AND USES THEREOF Niadyne Corporation (US) 2003-01-08 EP disclosed
WO-2001078660-A2 TOPICAL MICRONUTRIENT DELIVERY SYSTEM AND USES THEREOF NIADYNE CORPORATION (US) 2001-10-25 WO disclosed
EP-0951218-A1 CARNITINE-SUPPLEMENTED DIETS FOR GESTATING AND LACTATING SWINE KANSAS STATE UNIVERSITY RESEARCH FOUNDATION (US) 1999-10-27 EP disclosed
WO-1998024328-A1 CARNITINE-SUPPLEMENTED DIETS FOR GESTATING AND LACTATING SWINE KANSAS STATE UNIVERSITY RESEARCH FOUNDATION (US) 1998-06-11 WO disclosed
US-5238838-A Hydrolysis catalysts converting L-carnitine amide to L-carnitine; stereospecific DEGUSSA AKTIENGESELLSCHAFT (DE) 1993-08-24 US disclosed
US-4362719-A INSULIN, MIXTURES CAVAZZA CLAUDIO 1982-12-07 US disclosed
US-4272549-A CARNITINE CAVAZZA CLAUDIO 1981-06-09 US disclosed