SCHEMBL2842540

SCHEMBL2842540

CCC(=O)NCC(=O)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
RECQL P46063 1/20 0.42
GAA P10253 2/20 0.41
CA12 O43570 1/20 0.41
CA2 P00918 1/20 0.41
CA14 Q9ULX7 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.38
PTPRC P08575 2/20 0.38
TDP1 Q9NUW8 1/20 0.36
PSMB5 P28074 1/20 0.36
DGAT1 O75907 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
CYP2D6 P10635 1/20 0.35
CTSS P25774 1/20 0.35
CTSK P43235 1/20 0.35
TET2 Q6N021 1/20 0.34

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
SCHEMBL4814182 0.83 RECQL (0.42) MEN1KMT2ARECQLGAACA12
SCHEMBL4814188 0.83 RECQL (0.42) MEN1KMT2ARECQLGAACA12
SCHEMBL1709282 0.82 MEN1 (0.48) MEN1KMT2ARECQLGAACA12
SCHEMBL19876221 0.81 CA12 (0.41) MEN1KMT2ARECQLGAACA12
SCHEMBL23299718 0.81 RECQL (0.41) MEN1KMT2ARECQLGAACA12
SCHEMBL8558174 0.81 RECQL (0.50) MEN1KMT2ARECQLGAACA12
SCHEMBL4742448 0.81 RECQL (0.41) MEN1KMT2ARECQLGAACA12
SCHEMBL7376338 0.81 RECQL (0.41) MEN1KMT2ARECQLGAACA12
SCHEMBL20829083 0.81 RECQL (0.41) MEN1KMT2ARECQLGAACA12
SCHEMBL2842538 0.81 RECQL (0.41) MEN1KMT2ARECQLGAACA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8785443-B2 Methods of using prodrugs of methyl hydrogen fumarate and pharmaceutical compositions thereof XENOPORT, INC. (US) 2014-07-22 US claimed
WO-2014031901-A1 METHODS OF USE FOR MONOMETHYL FUMARATE AND PRODRUGS THEREOF XENOPORT, INC. (US) 2014-02-27 WO claimed
US-20100048651-A1 PRODRUGS OF METHYL HYDROGEN FUMARATE, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USE XENOPORT, INC. (US) 2010-02-25 US claimed
US-20240240229-A1 METHODS OF ADMINISTERING MONOMETHYL FUMARATE AND PRODRUGS THEREOF HAVING REDUCED SIDE EFFECTS HPS INVESTMENT PARTNERS, LLC, AS ADMINISTRATIVE AGENT 2024-07-18 US disclosed
EP-4227300-A1 TRUNCATED EVANS BLUE MODIFIED FIBROBLAST ACTIVATION PROTEIN INHIBITOR, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF Yantai Lannacheng Biotechnology Co., Ltd. (CN) 2023-08-16 EP disclosed
US-11084796-B2 Heterocyclic derivatives for the treatment of RSV GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2021-08-10 US disclosed
US-20210228525-A1 Methods of Administering Monomethyl Fumarate and Prodrugs Thereof Having Reduced Side Effects ARBOR PHARMACEUTICALS, LLC 2021-07-29 US disclosed
US-10945984-B2 Methods of administering monomethyl fumarate and prodrugs thereof having reduced side effects ARBOR PHARMACEUTICALS, LLC (US) 2021-03-16 US disclosed
US-10696690-B2 Imidazo-oxadiazole and imidazo-thiadiazole derivatives ARES TRADING S.A. (CH) 2020-06-30 US disclosed
US-10463642-B2 Methods of treating heart failure diseases using prodrugs of methyl hydrogen fumarate RAJASEKHAR VIJAYKUMAR (US) 2019-11-05 US disclosed
US-20190135770-A1 HETEROCYCLIC DERIVATIVES FOR THE TREATMENT OF RSV GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC. 2019-05-09 US disclosed
WO-2014031901-A1 METHODS OF USE FOR MONOMETHYL FUMARATE AND PRODRUGS THEREOF XENOPORT, INC. (US) 2014-02-27 WO disclosed
EP-2650279-A2 Prodrugs of methyl hydrogen fumarate, pharmaceutical compositions thereof, and methods of use XenoPort, Inc. (US) 2013-10-16 EP disclosed
US-20120157523-A1 PRODRUGS OF METHYL HYDROGEN FUMARATE, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USE XENOPORT, INC. (US) 2012-06-21 US disclosed
US-8093231-B2 Sulfonylethyl phosphorodiamidates TELIK, INC. (US) 2012-01-10 US disclosed
WO-2010022177-A2 PRODRUGS OF METHYL HYDROGEN FUMARATE, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USE XENOPORT, INC. (US) 2010-02-25 WO disclosed
US-20100048651-A1 PRODRUGS OF METHYL HYDROGEN FUMARATE, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USE XENOPORT, INC. (US) 2010-02-25 US disclosed
US-20080039429-A1 SULFONYLETHYL PHOSPHORODIAMIDATES TELIK, INC. 2008-02-14 US disclosed
US-7262182-B2 Sulfonylethyl phosphorodiamidates TELIK, INC. (US) 2007-08-28 US disclosed
US-20070015757-A1 Novel Glucagon Antagonists/Inverse Agonists NOVO NORDISK A/S (DK) 2007-01-18 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 (11 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-20120157523-A1 PRODRUGS OF METHYL HYDROGEN FUMARATE, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USE FH, MGMT, BHMT2 MEN1 887/4885KMT2A 242/4885RECQL 4021/4885
US-10945984-B2 Methods of administering monomethyl fumarate and prodrugs thereof having reduced side effects FH, FAH, ALDOA MEN1 1212/4885KMT2A 578/4885RECQL 1513/4885
US-10463642-B2 Methods of treating heart failure diseases using prodrugs of methyl hydrogen fumarate FH, HMGCR, HPGD MEN1 2286/4885KMT2A 1017/4885RECQL 2142/4885
US-20080039429-A1 SULFONYLETHYL PHOSPHORODIAMIDATES MTAP, TYMP, PHOSPHO1 MEN1 855/4885KMT2A 1619/4885RECQL 1743/4885
US-20240240229-A1 METHODS OF ADMINISTERING MONOMETHYL FUMARATE AND PRODRUGS THEREOF HAVING REDUCED SIDE EFFECTS GSTM1, GSTM2, GSTA1 MEN1 1620/4885KMT2A 438/4885RECQL 3124/4885
US-20100048651-A1 PRODRUGS OF METHYL HYDROGEN FUMARATE, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USE FH, MGMT, BHMT2 MEN1 887/4885KMT2A 242/4885RECQL 4021/4885
US-20190135770-A1 HETEROCYCLIC DERIVATIVES FOR THE TREATMENT OF RSV MAVS, HMGB3, NIPSNAP3A MEN1 3791/4885KMT2A 3637/4885RECQL 440/4885
US-20070015757-A1 Novel Glucagon Antagonists/Inverse Agonists GLP1R, GCGR, GIPR MEN1 1961/4885KMT2A 3612/4885RECQL 4779/4885
US-10696690-B2 Imidazo-oxadiazole and imidazo-thiadiazole derivatives APP, BACE1, PSEN1 MEN1 3481/4885KMT2A 4343/4885RECQL 1414/4885
US-20210228525-A1 Methods of Administering Monomethyl Fumarate and Prodrugs Thereof Having Reduced Side Effects FH, FAH, ALDOA MEN1 1212/4885KMT2A 578/4885RECQL 1513/4885
US-11084796-B2 Heterocyclic derivatives for the treatment of RSV MAVS, HMGB3, NIPSNAP3A MEN1 3791/4885KMT2A 3637/4885RECQL 440/4885

“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.