SCHEMBL555291

SCHEMBL555291

CCCCC(=CC(=O)O)C(=O)OC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.39
CES1 P23141 2/20 0.38
CES2 O00748 1/20 0.38
TSHR P16473 5/20 0.38
KDM4E B2RXH2 1/20 0.38
POLB P06746 1/20 0.36
POLA1 P09884 1/20 0.36
ALDH1A1 P00352 3/20 0.35
AKR1B1 P15121 1/20 0.35
TP53 P04637 1/20 0.35
HCAR2 Q8TDS4 1/20 0.35
GPR84 Q9NQS5 6/20 0.34
PPARG P37231 6/20 0.34
PPARD Q03181 6/20 0.34
PPARA Q07869 6/20 0.34
HDAC11 Q96DB2 5/20 0.34
TLR2 O60603 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
FABP4 P15090 2/20 0.34
PTPN1 P18031 2/20 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
SCHEMBL554182 0.94 AKR1B1 (0.43) APEX1CES1CES2TSHRPOLB
SCHEMBL555676 0.88 TSHR (0.40) CES1CES2TSHRKDM4EPOLB
SCHEMBL7772114 0.85 CES1 (0.38) APEX1CES1CES2TSHRPOLB
SCHEMBL9327902 0.85 CES1 (0.38) APEX1CES1CES2TSHRPOLB
SCHEMBL1581723 0.85 CES1 (0.38) APEX1CES1CES2TSHRALDH1A1
SCHEMBL3977487 0.85 CES1 (0.38) APEX1CES1CES2TSHRALDH1A1
SCHEMBL4795564 0.83 FAAH (0.44) APEX1CES1CES2TSHRALDH1A1
SCHEMBL9068911 0.82 CES1 (0.42) APEX1CES1CES2TSHRPOLB
SCHEMBL1034581 0.82 CES1 (0.42) APEX1CES1CES2TSHRPOLB
SCHEMBL4466781 0.81 HCAR2 (0.49) CES1CES2TSHRALDH1A1HCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220105064-A1 CONTROLLED RELEASE PHARMACEUTICAL COMPOSITIONS COMPRISING A FUMARIC ACID ESTER BIOGEN SWISS MFG GMBH (CH) 2022-04-07 US claimed
US-20220079884-A1 PHARMACEUTICAL FORMULATION COMPRISING ONE OR MORE FUMARIC ACID ESTERS IN AN EROSION MATRIX BIOGEN SWISS MFG GMBH (CH) 2022-03-17 US claimed
US-11229619-B2 Controlled release pharmaceutical compositions comprising a fumaric acid ester BIOGEN SWISS MANUFACTURING GMBH (CH) 2022-01-25 US claimed
US-20180221284-A1 PHARMACEUTICAL FORMULATION COMPRISING ONE OR MORE FUMARIC ACID ESTERS IN AN EROSION MATRIX BIOGEN SWISS MANUFACTURING GMBH (CH) 2018-08-09 US claimed
US-20150272894-A1 PHARMACEUTICAL FORMULATION COMPRISING ONE OR MORE FUMARIC ACID ESTERS IN AN EROSION MATRIX BIOGEN SWISS MANUFACTURING GMBH (CH) 2015-10-01 US claimed
US-20130259906-A1 PHARMACEUTICAL COMPOSITION COMPRISING ONE OR MORE FUMARIC ACID ESTERS FORWARD PHARMA A/S (DK) 2013-10-03 US claimed
US-20120034303-A1 PHARMACEUTICAL FORMULATION COMPRISING ONE OR MORE FUMARIC ACID ESTERS IN AN EROSION MATRIX FORWARD PHARMA A/S (DK) 2012-02-09 US claimed
US-20120034274-A1 PHARMACEUTICAL COMPOSITION COMPRISING ONE OR MORE FUMARIC ACID ESTERS FORWARD PHARMA A/S (DK) 2012-02-09 US claimed
EP-2379063-A1 PHARMACEUTICAL FORMULATION COMPRISING ONE OR MORE FUMARIC ACID ESTERS IN AN EROSION MATRIX Forward Pharma A/S (DK) 2011-10-26 EP claimed
EP-2379062-A1 PHARMACEUTICAL COMPOSITION COMPRISING ONE OR MORE FUMARIC ACID ESTERS Forward Pharma A/S (DK) 2011-10-26 EP claimed
WO-2010079222-A1 PHARMACEUTICAL FORMULATION COMPRISING ONE OR MORE FUMARIC ACID ESTERS IN AN EROSION MATRIX FORWARD PHARMA A/S (DK) 2010-07-15 WO claimed
WO-2010079221-A1 PHARMACEUTICAL COMPOSITION COMPRISING ONE OR MORE FUMARIC ACID ESTERS FORWARD PHARMA A/S (DK) 2010-07-15 WO 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
US-20220105064-A1 CONTROLLED RELEASE PHARMACEUTICAL COMPOSITIONS COMPRISING A FUMARIC ACID ESTER BIOGEN SWISS MFG GMBH (CH) 2022-04-07 US disclosed
US-20220079884-A1 PHARMACEUTICAL FORMULATION COMPRISING ONE OR MORE FUMARIC ACID ESTERS IN AN EROSION MATRIX BIOGEN SWISS MFG GMBH (CH) 2022-03-17 US disclosed
US-11229619-B2 Controlled release pharmaceutical compositions comprising a fumaric acid ester BIOGEN SWISS MANUFACTURING GMBH (CH) 2022-01-25 US disclosed
WO-2007006307-A2 NOVEL SALTS OF FUMARIC ACID MONOALKYLESTERS AND THEIR PHARMACEUTICAL USE ADITECH PHARMA AB (SE) 2007-01-18 WO disclosed
WO-2007006308-A1 NOVEL GLUCOPYRANOSE ESTERS AND GLUCOFURANOSE ESTERS OF ALKYL- FU MARATES AND THEIR PHARMACEUTICAL USE ADITECH PHARMA AB (SE) 2007-01-18 WO disclosed
WO-2006050730-A1 NOVEL SALTS OF FUMARIC ACID MONOALKYLESTERS AND THEIR PHARMACEUTICAL USE ADITECH PHARMA AB (SE) 2006-05-18 WO disclosed
WO-2006037342-A2 CONTROLLED RELEASE PHARMACEUTICAL COMPOSITIONS COMPRISING A FUMARIC ACID ESTER ADITECH PHARMA AB (SE) 2006-04-13 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 (1 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-20240240229-A1 METHODS OF ADMINISTERING MONOMETHYL FUMARATE AND PRODRUGS THEREOF HAVING REDUCED SIDE EFFECTS GSTM1, GSTM2, GSTA1 APEX1 623/4885CES1 293/4885CES2 2039/4885

“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.