SCHEMBL4669376

SCHEMBL4669376

NC(=O)OCCCN1CC2CNCC(C1)O2

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.33
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31
LMNA P02545 1/20 0.30
HRH2 P25021 1/20 0.30
HRH1 P35367 1/20 0.30

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
SCHEMBL4667545 0.75 LMNA (0.49) HRH3ALDH1A1KDM4EPOLBLMNA
SCHEMBL4726752 0.73 ALDH1A1 (0.35) ALDH1A1KDM4ELMNA
SCHEMBL8814790 0.71 CXCR4 (0.43) HRH3ALDH1A1KDM4ELMNAHRH2
SCHEMBL3311902 0.70 KDM4E (0.33) ALDH1A1KDM4E
SCHEMBL3127669 0.69 AVPR1A (0.34) POLB
SCHEMBL8939921 0.68 GAA (0.53) HRH3ALDH1A1KDM4ELMNA
SCHEMBL3126033 0.68 MEN1 (0.34)
SCHEMBL31243628 0.67 CYP2D6 (0.54) HRH3ALDH1A1KDM4EPOLB
SCHEMBL22266346 0.67 CXCR4 (0.44) ALDH1A1KDM4ELMNAHRH2HRH1
SCHEMBL29056699 0.67 HRH3 (0.41) HRH3HRH2HRH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1893619-A1 NEW OXABISPIDINE COMPOUNDS FOR THE TREATMENT OF CARDIAC ARRHYTMIAS AstraZeneca AB (SE) 2008-03-05 EP disclosed
WO-2006135316-A1 New oxabispidine compounds for the treatment of cardiac arrhythmias ASTRAZENECA AB (SE) 2006-12-21 WO disclosed