SCHEMBL6741203

SCHEMBL6741203

CCNC(=O)N1CC2CC(CN(CCc3ccc(C#N)cc3)C2)C1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KCNJ1 P48048 3/20 0.47
KCNH2 Q12809 3/20 0.47
CHRNA7 P36544 1/20 0.42
DRD2 P14416 5/20 0.41
DRD3 P35462 5/20 0.41
KDM1A O60341 3/20 0.41
CHRNB2 P17787 2/20 0.40
CHRNB4 P30926 2/20 0.40
CHRNA3 P32297 2/20 0.40
CHRNA4 P43681 2/20 0.40
ALDH1A1 P00352 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
FAAH O00519 1/20 0.38

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
SCHEMBL6736841 0.94 HTR1A (0.41) KCNJ1KCNH2CHRNA7DRD2DRD3
SCHEMBL6738151 0.86 KCNA5 (0.47) CHRNA7ALDH1A1
SCHEMBL6741315 0.85 KCNJ1 (0.46) KCNJ1KCNH2CHRNA7DRD2DRD3
SCHEMBL6743201 0.85 NAMPT (0.44) KCNJ1KCNH2CHRNA7DRD2DRD3
SCHEMBL7948923 0.84 KCNH2 (0.52) KCNJ1KCNH2DRD2DRD3L3MBTL1
SCHEMBL6739016 0.84 FAAH (0.44) KCNH2CHRNA7DRD2DRD3ALDH1A1
SCHEMBL6999087 0.83 KCNH2 (0.67) KCNJ1KCNH2DRD2DRD3
SCHEMBL6738742 0.82 HRH2 (0.45) CHRNA7ALDH1A1
SCHEMBL6741934 0.82 KDM1A (0.38) KCNJ1KCNH2CHRNA7DRD2DRD3
SCHEMBL6737928 0.81 GRIN2B (0.46) KCNH2CHRNA7CHRNB2CHRNB4CHRNA3

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 KCNJ1 167/4885KCNH2 13/4885CHRNA7 645/4885

“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.