SCHEMBL6732909

SCHEMBL6732909

CCNC(=O)N1CC2CC(CN(Cc3ccccc3)C2)C1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.50
ALDH1A1 P00352 2/20 0.50
FAAH O00519 2/20 0.46
HSD11B1 P28845 2/20 0.45
S1PR1 P21453 1/20 0.45
S1PR5 Q9H228 1/20 0.45
MEN1 O00255 1/20 0.44
TSHR P16473 1/20 0.44
HTT P42858 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MAPT P10636 1/20 0.44
FUCA1 P04066 2/20 0.43

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
SCHEMBL18498144 0.86 KDM4E (0.52) KDM4EALDH1A1FAAHS1PR1S1PR5
SCHEMBL18498200 0.86 KDM4E (0.52) KDM4EALDH1A1FAAHS1PR1S1PR5
SCHEMBL6738629 0.85 L3MBTL1 (0.52) TSHRL3MBTL1
SCHEMBL6739080 0.85 FAAH (0.40) KDM4EALDH1A1FAAHHSD11B1S1PR1
SCHEMBL6737613 0.84 FAAH (0.66) KDM4EFAAHMAPT
SCHEMBL6733582 0.83 CYP3A4 (0.46) KDM4EALDH1A1FAAHHSD11B1S1PR1
SCHEMBL1895069 0.82 CYP2D6 (0.54) ALDH1A1HSD11B1S1PR1S1PR5MEN1
SCHEMBL6318888 0.82 S1PR5 (0.53) ALDH1A1FAAHHSD11B1S1PR1S1PR5
SCHEMBL9520601 0.81 FAAH (0.62) KDM4EALDH1A1FAAHTSHRSMN1; SMN2
SCHEMBL9520911 0.80 MAPT (0.63) KDM4EALDH1A1FAAHTSHRSMN1; SMN2

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 KDM4E 4541/4885ALDH1A1 790/4885FAAH 942/4885

“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.