SCHEMBL6093889

SCHEMBL6093889

CCOC(=O)N1CC2CN(C[C@H](O)COc3ccc(C#N)cc3)CC2C1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.55
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
KCNH2 Q12809 1/20 0.52
ALDH1A1 P00352 2/20 0.51
KDM4E B2RXH2 2/20 0.51
HRH2 P25021 1/20 0.50
HRH1 P35367 1/20 0.50
HRH3 Q9Y5N1 1/20 0.50
USP2 O75604 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MAPT P10636 1/20 0.47
RECQL P46063 1/20 0.46
TSHR P16473 1/20 0.46

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
SCHEMBL6317264 0.95 POLB (0.53) POLBMEN1KMT2AKCNH2ALDH1A1
SCHEMBL6620975 0.91 MEN1 (0.52) POLBMEN1KMT2AKCNH2ALDH1A1
SCHEMBL6317262 0.91 MEN1 (0.52) POLBMEN1KMT2AKCNH2ALDH1A1
SCHEMBL2956759 0.90 KCNH2 (0.62) POLBMEN1KMT2AKCNH2ALDH1A1
SCHEMBL6096768 0.90 KCNH2 (0.49) POLBMEN1KMT2AKCNH2ALDH1A1
SCHEMBL6096348 0.89 KCNH2 (0.48) POLBMEN1KMT2AKCNH2ALDH1A1
SCHEMBL6095447 0.88 KCNH2 (0.47) POLBMEN1KMT2AKCNH2ALDH1A1
SCHEMBL6095152 0.87 KCNH2 (0.50) POLBMEN1KMT2AKCNH2ALDH1A1
SCHEMBL6096873 0.87 KCNH2 (0.50) POLBMEN1KMT2AKCNH2ALDH1A1
SCHEMBL6095179 0.86 MEN1 (0.56) POLBMEN1KMT2AKCNH2ALDH1A1

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-7144914-B2 3,7-diazabicyclo[3.3.0]octanes and their use in the treatment of cardiac arrhythmias ASTRAZENECA AB (SE) 2006-12-05 US disclosed
EP-1360187-B1 3,7-DIAZABICYCLO(3.3.0)OCTANES AND THEIR USE IN THE TREATMENT OF CARDIAC ARRHYTHMIAS ASTRAZENECA AB (SE) 2005-06-22 EP disclosed
US-20040053986-A1 3,7-Diazabicyclo[3.3.0]octanes and their use in the treatment of cardiac arrhythmias ASTRAZENECA AB (SE) 2004-03-18 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 (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-20040053986-A1 3,7-Diazabicyclo[3.3.0]octanes and their use in the treatment of cardiac arrhythmias KCNH1, KCNH2, CACNA1E POLB 1934/4885MEN1 2521/4885KMT2A 3620/4885

“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.