SCHEMBL267534

SCHEMBL267534

CS(=O)(=O)OCCOCCO

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
TSHR P16473 4/20 0.50
ALDH1A1 P00352 2/20 0.50
USP2 O75604 2/20 0.50
KDM4E B2RXH2 1/20 0.50
LMNA P02545 1/20 0.50
MMP9 P14780 1/20 0.50
ALOX15 P16050 1/20 0.50
MAPK1 P28482 1/20 0.48
THRB P10828 1/20 0.41
HTT P42858 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL18548563 1.00 MEN1 (0.52) MEN1KMT2ATSHRALDH1A1USP2
SCHEMBL1232002 1.00 MEN1 (0.52) MEN1KMT2ATSHRALDH1A1USP2
SCHEMBL3185849 1.00 MEN1 (0.52) MEN1KMT2ATSHRALDH1A1USP2
SCHEMBL996469 1.00 MEN1 (0.52) MEN1KMT2ATSHRALDH1A1USP2
SCHEMBL3181704 1.00 MEN1 (0.52) MEN1KMT2ATSHRALDH1A1USP2
SCHEMBL6578082 0.92 MEN1 (0.44) MEN1KMT2ATSHRALDH1A1USP2
SCHEMBL4140372 0.87 USP2 (0.63) TSHRALDH1A1USP2KDM4ELMNA
SCHEMBL4154180 0.87 USP2 (0.63) TSHRALDH1A1USP2KDM4ELMNA
SCHEMBL4149480 0.87 USP2 (0.63) TSHRALDH1A1USP2KDM4ELMNA
SCHEMBL4148516 0.87 USP2 (0.63) TSHRALDH1A1USP2KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008094203-A2 POLAR ESTER PRODRUGS OF HETEROCYCLIC HYBRID ANTIBACTERIAL COMPOUNDS AND SALTS THEREOF MICROBIOTIX, INC. (US) 2008-08-07 WO claimed
CN-107935943-B Ester-water amphiphilic hypocrellin derivative and preparation method and application thereof 中国科学院理化技术研究所 2021-06-29 CN disclosed
US-10844076-B2 Derivatives of 6-(2,3-dichlorophenyl)-1,2,4-triazin-5-amine NEKTAR THERAPEUTICS (US) 2020-11-24 US disclosed
US-10808050-B2 Antibody-drug conjugate having cyclic benzylidene acetal linker NOF CORPORATION (JP) 2020-10-20 US disclosed
CN-106604891-B Non-aqueous liquid and semi-solid formulations of amorphous calcium carbonate 艾玛菲克有限公司 2020-07-28 CN disclosed
US-20190309102-A1 ANTIBODY-DRUG CONJUGATE HAVING CYCLIC BENZYLIDENE ACETAL LINKER NOF CORPORATION (JP) 2019-10-10 US disclosed
US-10377837-B2 Antibody-drug conjugate having cyclic benzylidene acetal linker NOF CORPORATION (JP) 2019-08-13 US disclosed
US-20190071454-A1 DERIVATIVES OF 6-(2,3-DICHLOROPHENYL)-1,2,4-TRIAZIN-5-AMINE NEKTAR THERAPEUTICS 2019-03-07 US disclosed
US-10189859-B2 Derivatives of 6-(2,3-dichlorophenyl)-1,2,4-triazin-5-amine NEKTAR THERAPEUTICS (US) 2019-01-29 US disclosed
EP-2842940-B1 SULFORAPHANE-DERIVED COMPOUNDS, PRODUCTION METHOD THEREOF AND THE MEDICAL, FOOD AND COSMETIC USE OF SAME CONSEJO SUPERIOR INVESTIGACION (ES) 2018-04-25 EP disclosed
EP-2499113-A1 HOMOGLUTAMIC ACID DERIVATIVES Bayer Pharma Aktiengesellschaft (DE) 2012-09-19 EP disclosed
US-8133695-B2 Fluorescence polarization hERG assay Life Technologies Corporation (US) 2012-03-13 US disclosed
WO-2011057986-A1 HOMOGLUTAMIC ACID DERIVATIVES BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-05-19 WO disclosed
EP-2322514-A1 Homoglutamic acid and glutamic acid derivatives Bayer Schering Pharma Aktiengesellschaft (DE) 2011-05-18 EP disclosed
EP-1856073-B1 A PROCESS FOR THE PREPARATION OF AN 11-(4-SUBSTITUTED-I-PIPERAZINYL)DIBENZO[b,f][1,4]THIAZEPINE DERIVATIVE UNION QUIMICO FARMA (ES) 2010-05-12 EP disclosed
US-7655768-B2 Galactose derivative, drug carrier and medicinal composition NIPPON SHINYAKU CO., LTD. (JP) 2010-02-02 US disclosed
US-20090253148-A1 FLUORESCENCE POLARIZATION hERG ASSAY Life Technologies Corporation (US) 2009-10-08 US disclosed
WO-2008094203-A2 POLAR ESTER PRODRUGS OF HETEROCYCLIC HYBRID ANTIBACTERIAL COMPOUNDS AND SALTS THEREOF MICROBIOTIX, INC. (US) 2008-08-07 WO disclosed
US-20070244058-A1 Galactose Derivative, Drug Carrier and Medicinal Composition NIPPON SHINYAKU CO., LTD. (JP) 2007-10-18 US disclosed
US-7230101-B1 Synthesis of methotrexate-containing heterodimeric molecules GPC BIOTECH, INC. (US) 2007-06-12 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 (8 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-10377837-B2 Antibody-drug conjugate having cyclic benzylidene acetal linker H1-2, CD22, H1-0 MEN1 289/4885KMT2A 303/4885TSHR 96/4885
US-10844076-B2 Derivatives of 6-(2,3-dichlorophenyl)-1,2,4-triazin-5-amine KCNJ2, TRPC5, RYR2 MEN1 1531/4885KMT2A 464/4885TSHR 508/4885
US-10808050-B2 Antibody-drug conjugate having cyclic benzylidene acetal linker H1-2, CD22, H1-0 MEN1 289/4885KMT2A 303/4885TSHR 96/4885
US-20190309102-A1 ANTIBODY-DRUG CONJUGATE HAVING CYCLIC BENZYLIDENE ACETAL LINKER H1-2, CD22, H1-0 MEN1 289/4885KMT2A 303/4885TSHR 96/4885
US-20190071454-A1 DERIVATIVES OF 6-(2,3-DICHLOROPHENYL)-1,2,4-TRIAZIN-5-AMINE KCNJ2, TRPC5, RYR2 MEN1 1531/4885KMT2A 464/4885TSHR 508/4885
US-20070244058-A1 Galactose Derivative, Drug Carrier and Medicinal Composition GALK1, GALE, UGGT1 MEN1 4716/4885KMT2A 2876/4885TSHR 2018/4885
US-10189859-B2 Derivatives of 6-(2,3-dichlorophenyl)-1,2,4-triazin-5-amine KCNJ2, TRPC5, RYR2 MEN1 1531/4885KMT2A 464/4885TSHR 508/4885
US-20090253148-A1 FLUORESCENCE POLARIZATION hERG ASSAY TNNI3, TNNT2, KCNQ1 MEN1 3369/4885KMT2A 3201/4885TSHR 1889/4885

“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.