SCHEMBL527434

SCHEMBL527434

COC(=O)C1OC(C)(C)OC1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.42
ALDH1A1 P00352 2/20 0.42
ITGA4 P13612 1/20 0.42
NPSR1 Q6W5P4 2/20 0.38
MAPK1 P28482 1/20 0.38
PPM1B O75688 1/20 0.36
PTPN1 P18031 1/20 0.36
PPP1CC P36873 1/20 0.36
PGD P52209 1/20 0.35
SUCNR1 Q9BXA5 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.32
GAA P10253 1/20 0.31
POLB P06746 1/20 0.31
KDM4E B2RXH2 1/20 0.30
CYP1A2 P05177 1/20 0.30
HIF1A Q16665 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
SCHEMBL13587126 1.00 MAPT (0.42) MAPTALDH1A1ITGA4NPSR1MAPK1
SCHEMBL5775317 1.00 MAPT (0.42) MAPTALDH1A1ITGA4NPSR1MAPK1
SCHEMBL2526095 1.00 MAPT (0.42) MAPTALDH1A1ITGA4NPSR1MAPK1
SCHEMBL675867 0.91 ALDH1A1 (0.47) MAPTALDH1A1ITGA4NPSR1MAPK1
SCHEMBL9979878 0.91 ALDH1A1 (0.47) MAPTALDH1A1ITGA4NPSR1MAPK1
SCHEMBL2749036 0.91 ALDH1A1 (0.47) MAPTALDH1A1ITGA4NPSR1MAPK1
SCHEMBL10266772 0.91 ALDH1A1 (0.47) MAPTALDH1A1ITGA4NPSR1MAPK1
SCHEMBL12826506 0.91 ALDH1A1 (0.47) MAPTALDH1A1ITGA4NPSR1MAPK1
SCHEMBL15504441 0.86 MAPT (0.39) MAPTALDH1A1ITGA4NPSR1MAPK1
SCHEMBL1595064 0.84 SUCNR1 (0.45) ALDH1A1NPSR1MAPK1PGDSUCNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11695158-B2 Nonaqueous electrolyte, capacitor device using same, and carboxylic acid ester compound used in same MU IONIC SOLUTIONS CORPORATION (JP) 2023-07-04 US claimed
US-20210320334-A1 NONAQUEOUS ELECTROLYTE, CAPACITOR DEVICE USING SAME, AND CARBOXYLIC ACID ESTER COMPOUND USED IN SAME MU IONIC SOLUTIONS CORPORATION (JP) 2021-10-14 US claimed
US-20190198928-A1 NONAQUEOUS ELECTROLYTE, CAPACITOR DEVICE USING SAME, AND CARBOXYLIC ACID ESTER COMPOUND USED IN SAME UBE INDUSTRIES, LTD. (JP) 2019-06-27 US claimed
US-8975232-B2 Macrocyclic kinase inhibitors and uses thereof PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2015-03-10 US disclosed
US-8853224-B2 Acyclic amine inhibitors of nucleoside phosphorylases and hydrolases INDUSTRIAL RESEARCH LIMITED (NZ) 2014-10-07 US disclosed
US-20130178429-A1 MACROCYCLIC KINASE INHIBITORS AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2013-07-11 US disclosed
WO-2012016186-A1 MACROCYCLIC KINASE INHIBITORS AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2012-02-02 WO disclosed
EP-2395005-A1 Acyclic amine inhibitors of nucleoside phosphorylases and hydrolases Industrial Research Limited (NZ) 2011-12-14 EP disclosed
US-8039467-B2 Compounds for the treatment of inflammatory disorders SCHERING CORPORATION (US) 2011-10-18 US disclosed
US-20110130412-A1 Acyclic amine inhibitors of nucleoside phosphorylases and hydrolases BIOCRYST PHARMACEUTICALS, INC. 2011-06-02 US disclosed
EP-2057165-B1 ACYCLIC AMINE INHIBITORS OF NUCLEOSIDE PHOSPHORYLASES AND HYDROLASES IND RES LTD (NZ) 2011-03-16 EP disclosed
US-7041345-B2 Chiral compounds III MERCK PATENT GMBH (DE) 2006-05-09 US disclosed
US-7022689-B2 5-amidino-n-(2-aminophenethyl)-n-hydroxy-benzenesulffonamide derivative, medical composition containing the same, pharmaceutical use thereof and intermediate therefor KISSEI PHARMACEUTICAL CO., LTD. (JP) 2006-04-04 US disclosed
WO-2005121130-A2 CHEMICAL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM FOR THE TREATMENT OF INFLAMMATORY DISORDERS SCHERING CORPORATION (US) 2005-12-22 WO disclosed
US-20040242455-A1 5-amidino-n-(2-aminophenethyl)-n-hydroxy-benzenesulffonamide derivative, medical composition containing the same, pharmaceutical use thereof and intermediate therefor KISSEI PAHRMACEUTICAL CO., LTD. (JP) 2004-12-02 US disclosed
EP-1299375-B1 CHIRAL COMPOUNDS III MERCK PATENT GMBH (DE) 2004-08-18 EP disclosed
EP-1415983-A1 5-AMIDINO-N-(2-AMINOPHENETHYL)-HYDROXYBENZENESULFONAMIDE DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, AND INTERMEDIATE THEREFOR Kissei Pharmaceutical Co., Ltd. (JP) 2004-05-06 EP disclosed
US-20030189189-A1 Chiral compounds III MERCK PATENT GMBH (DE) 2003-10-09 US disclosed
EP-1299375-A1 CHIRAL COMPOUNDS III MERCK PATENT GmbH (DE) 2003-04-09 EP disclosed
WO-2002006265-A1 CHIRAL COMPOUNDS III MERCK PATENT GMBH (DE) 2002-01-24 WO 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 (6 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-20190198928-A1 NONAQUEOUS ELECTROLYTE, CAPACITOR DEVICE USING SAME, AND CARBOXYLIC ACID ESTER COMPOUND USED IN SAME SLC9A2, VDAC1, SCO2 MAPT 4839/4885ALDH1A1 1748/4885ITGA4 310/4885
US-11695158-B2 Nonaqueous electrolyte, capacitor device using same, and carboxylic acid ester compound used in same SLC9A2, VDAC1, SCO2 MAPT 4839/4885ALDH1A1 1748/4885ITGA4 310/4885
US-20130178429-A1 MACROCYCLIC KINASE INHIBITORS AND USES THEREOF MAP3K20, MAP3K11, MAP3K1 MAPT 3649/4885ALDH1A1 3932/4885ITGA4 4317/4885
US-20110130412-A1 Acyclic amine inhibitors of nucleoside phosphorylases and hydrolases PNP, TYMP, NTPCR MAPT 2810/4885ALDH1A1 2065/4885ITGA4 3373/4885
US-20210320334-A1 NONAQUEOUS ELECTROLYTE, CAPACITOR DEVICE USING SAME, AND CARBOXYLIC ACID ESTER COMPOUND USED IN SAME SLC9A2, VDAC1, SCO2 MAPT 4839/4885ALDH1A1 1748/4885ITGA4 310/4885
US-20040242455-A1 5-amidino-n-(2-aminophenethyl)-n-hydroxy-benzenesulffonamide derivative, medical composition containing the same, pharmaceutical use thereof and intermediate therefor F11, F2, F7 MAPT 4810/4885ALDH1A1 3590/4885ITGA4 2842/4885

“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.