SCHEMBL6325183

SCHEMBL6325183

CC1(O)C2CNCC1CN(C(=O)O)C2

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 17/20 0.38
CHRNA4 P43681 17/20 0.38
CHRNB4 P30926 16/20 0.38
CHRNA3 P32297 16/20 0.38
CHRNA7 P36544 14/20 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
SCHEMBL20722399 0.78 CHRNB2 (0.35) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA7
SCHEMBL6323750 0.76 NR1H2 (0.44) CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL18668699 0.74 SMN1; SMN2 (0.36) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA7
SCHEMBL29963571 0.74 SMN1; SMN2 (0.36) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA7
SCHEMBL23523345 0.71 SMN1; SMN2 (0.32)
SCHEMBL29090938 0.71 SMN1; SMN2 (0.32)
SCHEMBL20898688 0.71 SMN1; SMN2 (0.32)
SCHEMBL29090937 0.71 SMN1; SMN2 (0.32)
SCHEMBL23523344 0.71 SMN1; SMN2 (0.32)
SCHEMBL25391666 0.70 CHRNB2 (0.64) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA7

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
US-6887881-B1 Bispidine compounds useful in the treatment of cardiac arrythmias ASTRAZENECA AB (SE) 2005-05-03 US disclosed
EP-1192154-B1 BISPIDINE COMPOUNDS USEFUL IN THE TREATMENT OF CARDIAC ARRHYTHMIAS ASTRAZENECA AB (SE) 2004-03-17 EP disclosed