SCHEMBL1906696

SCHEMBL1906696

C=CCOC(=O)/C=C/C(=O)O.[MgH2]

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.58
CACNA1B Q00975 1/20 0.58
APBA1 Q02410 1/20 0.58
HCAR2 Q8TDS4 12/20 0.54
APP P05067 1/20 0.44
TSHR P16473 4/20 0.39
TP53 P04637 1/20 0.39
EGLN1 Q9GZT9 1/20 0.39
EGLN3 Q9H6Z9 1/20 0.39
CYP3A4 P08684 1/20 0.38
ATM Q13315 1/20 0.34
ALDH1A1 P00352 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL1906699 1.00 MAPT (0.58) MAPTCACNA1BAPBA1HCAR2APP
SCHEMBL27834457 0.98 MAPT (0.60) MAPTCACNA1BAPBA1HCAR2APP
SCHEMBL254252 0.98 MAPT (0.60) MAPTCACNA1BAPBA1HCAR2APP
Fumaric Acid SCHEMBL27729433 0.98 MAPT (0.60) MAPTCACNA1BAPBA1HCAR2APP
SCHEMBL39644 0.98 MAPT (0.60) MAPTCACNA1BAPBA1HCAR2APP
Fumaric Acid SCHEMBL27834458 0.98 MAPT (0.60) MAPTCACNA1BAPBA1HCAR2APP
SCHEMBL39643 0.98 MAPT (0.60) MAPTCACNA1BAPBA1HCAR2APP
SCHEMBL29985915 0.98 MAPT (0.60) MAPTCACNA1BAPBA1HCAR2APP
Ethylene SCHEMBL436694 0.96 MAPT (0.58) MAPTCACNA1BAPBA1HCAR2APP
SCHEMBL1906274 0.96 MAPT (0.58) MAPTCACNA1BAPBA1HCAR2APP

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080233185-A1 Fumaric Acid Derivatives as NF-kappaB Inhibitor FUMAPHARM AG 2008-09-25 US claimed
EP-1248606-B1 USE OF FUMARIC ACID DERIVATIVES FOR TREATING MITOCHONDRIAL DISEASES FUMAPHARM AG (CH) 2006-06-14 EP claimed
US-6858750-B2 Use of fumaric acid derivatives for treating mitochondrial diseases FUMAPHARM AG (CH) 2005-02-22 US claimed
US-20040054001-A1 Fumaric acid derivatives as nf-kappab inhibitors FUMAPHARM AG (CH) 2004-03-18 US claimed
WO-2016074684-A1 FUMARIC ACID DERIVATIVES FOR MEDICAL USE SYDDANSK UNIVERSITET (DK) 2016-05-19 WO disclosed
US-20160030374-A1 USE OF FUMARIC ACID DERIVATIVES FOR TREATING CARDIAC INSUFFICIENCY, AND ASTHMA FUMAPHARM AG (CH) 2016-02-04 US disclosed
US-8980832-B2 Use of fumaric acid derivatives for treating cardiac insufficiency, and asthma BIOGEN IDEC INTERNATIONAL GMBH (CH) 2015-03-17 US disclosed
US-20110124615-A1 USE OF FUMARIC ACID DERIVATIVES FOR TREATING CARDIAC INSUFFICIENCY, AND ASTHMA FUMAPHARM AG 2011-05-26 US disclosed
US-20080233185-A1 Fumaric Acid Derivatives as NF-kappaB Inhibitor FUMAPHARM AG 2008-09-25 US disclosed
EP-1913942-A2 The use of fumaric acid derivatives for treating cardiac insufficiency, and asthma Fumapharm AG (CH) 2008-04-23 EP disclosed
EP-1663197-B1 THE USE OF FUMARIC ACID DERIVATIVES FOR TREATING CARDIAC INSUFFICIENCY, AND ASTHMA FUMAPHARM AG (CH) 2007-12-05 EP disclosed
US-20070027076-A1 Use of fumaric acid derivatives for treating cardiac insufficiency, and asthma FUMAPHAM AG 2007-02-01 US disclosed
EP-1663197-A1 THE USE OF FUMARIC ACID DERIVATIVES FOR TREATING CARDIAC INSUFFICIENCY, AND ASTHMA Fumapharm AG (CH) 2006-06-07 EP disclosed
WO-2005023241-A1 THE USE OF FUMARIC ACID DERIVATIVES FOR TREATING CARDIAC INSUFFICIENCY, AND ASTHMA FUMAPHARM AG (CH) 2005-03-17 WO disclosed
US-6858750-B2 Use of fumaric acid derivatives for treating mitochondrial diseases FUMAPHARM AG (CH) 2005-02-22 US disclosed
US-20040054001-A1 Fumaric acid derivatives as nf-kappab inhibitors FUMAPHARM AG (CH) 2004-03-18 US disclosed
US-20030013761-A1 Use of fumaric acid derivatives for treating mitochondrial diseases BIOGEN INTERNATIONAL GMBH (CH) 2003-01-16 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 (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-20040054001-A1 Fumaric acid derivatives as nf-kappab inhibitors NFKBIA, NFKB1, NFKB2 MAPT 730/4885CACNA1B 4032/4885APBA1 251/4885
US-20160030374-A1 USE OF FUMARIC ACID DERIVATIVES FOR TREATING CARDIAC INSUFFICIENCY, AND ASTHMA FH, FAH, AADAC MAPT 4232/4885CACNA1B 595/4885APBA1 2089/4885
US-20080233185-A1 Fumaric Acid Derivatives as NF-kappaB Inhibitor NFKBIA, NFKB1, NFKB2 MAPT 743/4885CACNA1B 4011/4885APBA1 254/4885
US-20070027076-A1 Use of fumaric acid derivatives for treating cardiac insufficiency, and asthma FH, FAH, AADAC MAPT 4232/4885CACNA1B 595/4885APBA1 2089/4885
US-20030013761-A1 Use of fumaric acid derivatives for treating mitochondrial diseases FH, HADHA, HADH MAPT 139/4885CACNA1B 4332/4885APBA1 1241/4885
US-20110124615-A1 USE OF FUMARIC ACID DERIVATIVES FOR TREATING CARDIAC INSUFFICIENCY, AND ASTHMA FH, FAH, AADAC MAPT 4232/4885CACNA1B 595/4885APBA1 2089/4885

“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.