SCHEMBL6738151

SCHEMBL6738151

CCNC(=O)N1CC2CC(CN(CCOc3ccc(C#N)cc3)C2)C1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 6/20 0.47
HRH2 P25021 7/20 0.46
HRH1 P35367 7/20 0.46
HRH3 Q9Y5N1 4/20 0.46
CHRNA7 P36544 1/20 0.44
KDM4E B2RXH2 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL6738742 0.94 HRH2 (0.45) KCNA5HRH2HRH1HRH3CHRNA7
SCHEMBL6096450 0.89 HRH2 (0.53) KCNA5HRH2HRH1HRH3CHRNA7
SCHEMBL6740378 0.87 HRH3 (0.42) KCNA5HRH2HRH1HRH3CHRNA7
SCHEMBL2967829 0.86 KCNH2 (0.48) KCNA5HRH2HRH1HRH3CHRNA7
SCHEMBL6741203 0.86 KCNJ1 (0.47) CHRNA7ALDH1A1
SCHEMBL6741917 0.85 HRH2 (0.44) HRH2HRH1HRH3CHRNA7
SCHEMBL7477901 0.85 KCNA5 (0.39) KCNA5HRH2HRH1HRH3CHRNA7
SCHEMBL6995606 0.84 HRH3 (0.49) KCNA5HRH2HRH1HRH3KDM4E
SCHEMBL7480678 0.84 MMP2 (0.38) KCNA5HRH2HRH1HRH3CHRNA7
SCHEMBL6739387 0.84 KCNH2 (0.50) KDM4ESMN1; SMN2ALDH1A1MAPT

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 1 patent. 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

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 KCNA5 81/4885HRH2 113/4885HRH1 184/4885

“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.