SCHEMBL3129013

SCHEMBL3129013

N#Cc1ccc(OCCN2CC3CN(CCCN)CC(C2)O3)cc1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.55
HRH3 Q9Y5N1 18/20 0.54
HRH2 P25021 15/20 0.54
HRH1 P35367 15/20 0.54

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
Hydrochloric Acid SCHEMBL3127684 0.95 KCNH2 (0.57) KCNH2HRH3HRH2HRH1
SCHEMBL3119483 0.92 KCNH2 (0.52) KCNH2HRH3HRH2HRH1
SCHEMBL3119858 0.91 KCNH2 (0.58) KCNH2HRH3HRH2HRH1
SCHEMBL2966798 0.91 KCNH2 (0.53) KCNH2HRH3HRH2HRH1
SCHEMBL2960597 0.88 MEN1 (0.56) KCNH2HRH3HRH2HRH1
SCHEMBL2956719 0.86 KCNA5 (0.53) KCNH2HRH3HRH2HRH1
SCHEMBL3124752 0.84 KCNH2 (0.48) KCNH2HRH3HRH2HRH1
SCHEMBL2967582 0.84 KCNH2 (0.52) KCNH2HRH3HRH2HRH1
SCHEMBL2963123 0.83 KCNH2 (0.56) KCNH2HRH3HRH2HRH1
Hydrochloric Acid SCHEMBL3132895 0.83 KCNH2 (0.47) KCNH2HRH3HRH2HRH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7648985-B2 Oxabispidine compounds and their use in the treatment of cardiac arrhythmias ASTRAZENECA AB (SE) 2010-01-19 US disclosed
US-20090270383-A1 Novel Oxabispidine Compounds And Their Use In The Treatment Of Cardiac Arrhythmias ASTRAZENECA AB (SE) 2009-10-29 US disclosed
US-20090005558-A1 Novel Oxabispidine Compounds and Their Use in the Treatment of Cardiac Arrhythmias ASTRAZENECA AB (SE) 2009-01-01 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 (2 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-20090270383-A1 Novel Oxabispidine Compounds And Their Use In The Treatment Of Cardiac Arrhythmias KCNH1, RYR1, CACNA1E KCNH2 8/4885HRH3 437/4885HRH2 616/4885
US-20090005558-A1 Novel Oxabispidine Compounds and Their Use in the Treatment of Cardiac Arrhythmias KCNH1, RYR1, CACNA1E KCNH2 8/4885HRH3 437/4885HRH2 616/4885

“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.