SCHEMBL2964698

SCHEMBL2964698

N#Cc1ccc(OC[C@@H](O)CN2CC3CN(C(=O)O)CC(C2)O3)cc1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.64
KDM4E B2RXH2 3/20 0.54
ALDH1A1 P00352 2/20 0.54
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
MAPK1 P28482 4/20 0.50
POLB P06746 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
MAPT P10636 1/20 0.43
ABCB1 P08183 2/20 0.43
AGER Q15109 1/20 0.43
ATM Q13315 1/20 0.42
HPGD P15428 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL6151398 1.00 KCNH2 (0.64) KCNH2KDM4EALDH1A1MEN1KMT2A
SCHEMBL2966219 0.91 KCNH2 (0.70) KCNH2KDM4EALDH1A1MEN1KMT2A
SCHEMBL2966221 0.91 KCNH2 (0.70) KCNH2KDM4EALDH1A1MEN1KMT2A
SCHEMBL6095179 0.89 MEN1 (0.56) KCNH2KDM4EALDH1A1MEN1KMT2A
SCHEMBL2956759 0.88 KCNH2 (0.62) KCNH2KDM4EALDH1A1MEN1KMT2A
SCHEMBL2969679 0.86 KCNH2 (0.63) KCNH2KDM4EALDH1A1MEN1KMT2A
SCHEMBL2959969 0.86 KCNH2 (0.61) KCNH2KDM4EALDH1A1MEN1KMT2A
SCHEMBL6316718 0.86 MEN1 (0.53) KCNH2KDM4EALDH1A1MEN1KMT2A
SCHEMBL6316723 0.86 MEN1 (0.53) KCNH2KDM4EALDH1A1MEN1KMT2A
SCHEMBL6619543 0.86 MEN1 (0.53) KCNH2KDM4EALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7772229-B2 Oxabispidine compounds useful in the treatment of cardiac arrhythmias ASTRAZENECA AB (SE) 2010-08-10 US disclosed
US-20090326221-A1 New oxabispidine compunds useful in the treatment of cardiac arrhythmias ASTRAZENECA AB, (SE) 2009-12-31 US disclosed
US-7351821-B2 Oxabispidine compounds useful in the treatment of cardiac arrhythmias ASTRAZENECA AB (SE) 2008-04-01 US disclosed
US-20070117799-A1 Oxabispidine compounds useful in the treatment of cardiac arrhythmias ASTRAZENECA AB, SODERTALJE, SWEDEN 2007-05-24 US disclosed
US-7217708-B2 Cardiovascular disorders ASTRAZENECA AB (SE) 2007-05-15 US disclosed
US-7164017-B2 Oxabispidine compounds useful in the treatment of cardiac arrhythmias ASTRAZENECA AB (SE) 2007-01-16 US disclosed
US-20060166980-A1 New oxabispidine compounds useful in the treatment of cardiac arrhythmias ASTRAZENECA AB (SE) 2006-07-27 US disclosed
US-20060166979-A1 New oxabispidine compounds useful in the treatment of cardiac arrhythmias ASTRAZENECA AB (SE) 2006-07-27 US disclosed
EP-1389212-B1 3,7-DIAZABICYCLO 3.3.1| FORMULATIONS AS ANTI-ARRYTHMIC COMPOUNDS ASTRAZENECA AB (SE) 2006-07-12 EP disclosed
EP-1389213-B1 3,7-DIAZABICYCLO 3.3.1| FORMULATIONS AS ANTIARHYTHMIC COMPOUNDS ASTRAZENECA AB (SE) 2006-04-12 EP disclosed
EP-1559717-A2 Oxabispidine compounds useful in the treatment of cardiac arrythmias AstraZeneca AB (SE) 2005-08-03 EP disclosed
EP-1550663-A1 New crystalline forms of antiarrhythmic compounds Astra Zeneca AB (SE) 2005-07-06 EP disclosed
EP-1235831-B1 NEW OXABISPIDINE COMPOUNDS USEFUL IN THE TREATMENT OF CARDIAC ARRHYTHMIAS ASTRAZENECA AB (SE) 2005-03-30 EP disclosed
US-20050037067-A1 3,7-Diazabicyclo [3.3.1]formulations as anti-arrhythmic compounds ASTRAZENECA AB (SE) 2005-02-17 US disclosed
US-20040143000-A1 3,7-diazabicyclo [3.3.1] formulations as antiarhythmic compounds ASTRAZENECA AB (SE) 2004-07-22 US disclosed
US-20040132798-A1 3.7-Diazybicyclo [3.3.1] formulations as antiarrhythmic compounds ASTRAZENECA AB (SE) 2004-07-08 US disclosed
US-20030153564-A1 New oxabispidine compounds useful in the treatment of cardiac arrhythmias ASTRAZENECA AB 2003-08-14 US disclosed
US-6559143-B1 Class III electrophysiological activity, drugs which prolong the trans-membrane action potential duration and refractoriness, without affecting cardiac conduction ASTRAZENECA AB (SE) 2003-05-06 US disclosed
EP-1235831-A2 NEW OXABISPIDINE COMPOUNDS USEFUL IN THE TREATMENT OF CARDIAC ARRHYTHMIAS AstraZeneca AB (SE) 2002-09-04 EP disclosed
WO-2001028992-A2 NEW OXABISPIDINE COMPOUNDS USEFUL IN THE TREATMENT OF CARDIAC ARRHYTHMIAS ASTRAZENECA AB (SE) 2001-04-26 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 (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-20030153564-A1 New oxabispidine compounds useful in the treatment of cardiac arrhythmias KCNH1, CACNA1E, RYR1 KCNH2 9/4885KDM4E 4163/4885ALDH1A1 321/4885
US-20050037067-A1 3,7-Diazabicyclo [3.3.1]formulations as anti-arrhythmic compounds CACNA1G, CACNA1I, CACNA1B KCNH2 29/4885KDM4E 460/4885ALDH1A1 1090/4885
US-20090326221-A1 New oxabispidine compunds useful in the treatment of cardiac arrhythmias KCNH1, CACNA1E, SCN1B KCNH2 11/4885KDM4E 3938/4885ALDH1A1 557/4885
US-20060166979-A1 New oxabispidine compounds useful in the treatment of cardiac arrhythmias KCNH1, RYR1, CACNA1E KCNH2 8/4885KDM4E 4083/4885ALDH1A1 539/4885
US-20070117799-A1 Oxabispidine compounds useful in the treatment of cardiac arrhythmias KCNH1, RYR1, CACNA1E KCNH2 12/4885KDM4E 3987/4885ALDH1A1 534/4885
US-20040132798-A1 3.7-Diazybicyclo [3.3.1] formulations as antiarrhythmic compounds HCN3, CACNB3, TNNI3 KCNH2 51/4885KDM4E 768/4885ALDH1A1 2388/4885
US-20040143000-A1 3,7-diazabicyclo [3.3.1] formulations as antiarhythmic compounds SCN3A, KCNH1, CACNA1G KCNH2 34/4885KDM4E 743/4885ALDH1A1 1430/4885
US-20060166980-A1 New oxabispidine compounds useful in the treatment of cardiac arrhythmias KCNH1, RYR1, CACNA1E KCNH2 8/4885KDM4E 4083/4885ALDH1A1 539/4885

“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.