SCHEMBL6733478

SCHEMBL6733478

N#Cc1ccc(OCC(O)CN2CC3CC(C2)CN(C(=O)NCC(=O)NCC2CC2)C3)cc1

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.44
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
PRMT5 O14744 1/20 0.38
WDR77 Q9BQA1 1/20 0.38
CASP2 P42575 1/20 0.38
AGER Q15109 1/20 0.38
KDM1A O60341 1/20 0.37
EGLN2 Q96KS0 1/20 0.37
CHRNA7 P36544 1/20 0.37
ATM Q13315 1/20 0.36
POLB P06746 1/20 0.36
MAPK1 P28482 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 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
SCHEMBL6742210 0.94 MEN1 (0.47) KCNH2KDM4EALDH1A1MEN1KMT2A
SCHEMBL6743065 0.94 MEN1 (0.47) KCNH2KDM4EALDH1A1MEN1KMT2A
SCHEMBL6733792 0.94 MEN1 (0.47) KCNH2KDM4EALDH1A1MEN1KMT2A
SCHEMBL6735514 0.89 KCNH2 (0.48) KCNH2KDM4EALDH1A1MEN1KMT2A
SCHEMBL6739623 0.89 KCNH2 (0.48) KCNH2KDM4EALDH1A1MEN1KMT2A
SCHEMBL7474790 0.87 KCNH2 (0.47) KCNH2KDM4EALDH1A1MEN1KMT2A
SCHEMBL6095326 0.86 MEN1 (0.50) KCNH2KDM4EALDH1A1MEN1KMT2A
SCHEMBL6739436 0.85 KCNH2 (0.50) KCNH2KDM4EALDH1A1MEN1KMT2A
SCHEMBL6739387 0.85 KCNH2 (0.50) KCNH2KDM4EALDH1A1MEN1KMT2A
SCHEMBL6742834 0.85 KCNH2 (0.50) KCNH2KDM4EALDH1A1MEN1KMT2A

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-20040229900-A1 Bispidine compounds useful in the treatment of cardiac arrythmias ASTRAZENECA AB (SE) 2004-11-18 US 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 KCNH2 13/4885KDM4E 4541/4885ALDH1A1 790/4885

“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.