SCHEMBL6733487

SCHEMBL6733487

CCNC(=O)N1CC2CC(CN(CC(N)COc3ccc(C#N)cc3)C2)C1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.40
KCNH2 Q12809 1/20 0.40
KDM1A O60341 1/20 0.38
MMP2 P08253 1/20 0.38
MMP3 P08254 1/20 0.38
TRPV4 Q9HBA0 2/20 0.37
GRIN1 Q05586 3/20 0.37
GRIN2B Q13224 3/20 0.37
MGLL Q99685 1/20 0.36
HRH3 Q9Y5N1 3/20 0.36
HRH2 P25021 3/20 0.36
HRH1 P35367 3/20 0.36

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
SCHEMBL6095730 0.91 CHRNA7 (0.41) CHRNA7KCNH2KDM1AMMP2MMP3
SCHEMBL6739387 0.89 KCNH2 (0.50) KCNH2
SCHEMBL6734797 0.89 KCNH2 (0.50) KCNH2
SCHEMBL6742834 0.89 KCNH2 (0.50) KCNH2
SCHEMBL6742582 0.89 CHRNA7 (0.40) CHRNA7KCNH2KDM1AMMP2MMP3
SCHEMBL6743187 0.88 GRIN1 (0.40) KCNH2KDM1AMMP2MMP3TRPV4
SCHEMBL6738018 0.88 KCNH2 (0.39) CHRNA7KCNH2KDM1AMMP2MMP3
SCHEMBL6738144 0.87 KCNH2 (0.39) CHRNA7KCNH2KDM1AMMP2MMP3
SCHEMBL6737648 0.86 KCNH2 (0.40) CHRNA7KCNH2KDM1AMMP2MMP3
SCHEMBL6737925 0.86 KCNH2 (0.40) CHRNA7KCNH2KDM1AMMP2MMP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040229900-A1 Bispidine compounds useful in the treatment of cardiac arrythmias ASTRAZENECA AB (SE) 2004-11-18 US disclosed
WO-2000077000-A9 NEW BISPIDINE COMPOUNDS USEFUL IN THE TREATMENT OF CARDIAC ARRHYTHMIAS ASTRAZENECA AB (SE) 2003-06-19 WO disclosed
EP-1192157-A1 BISPIDINE COMPOUNDS USEFUL IN THE TREATMENT OF CARDIAC ARRHYTHMIAS AstraZeneca AB (SE) 2002-04-03 EP disclosed
WO-2000077000-A1 NEW BISPIDINE COMPOUNDS USEFUL IN THE TREATMENT OF CARDIAC ARRHYTHMIAS ASTRAZENECA AB (SE) 2000-12-21 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-20040229900-A1 Bispidine compounds useful in the treatment of cardiac arrythmias ADRA1B, ADRB2, ADRA1D CHRNA7 645/4885KCNH2 13/4885KDM1A 4132/4885

“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.