SCHEMBL3237224

SCHEMBL3237224

CC(C)OC(=O)N1CC2CCC(C1)NC2

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CHRNB2 P17787 16/20 0.42
▸ CHRNA4 P43681 16/20 0.42
▸ CHRNA3 P32297 15/20 0.42
▸ CHRNB4 P30926 13/20 0.42
▸ CHRNA7 P36544 12/20 0.42
▸ CHRNB3 Q05901 2/20 0.33
▸ CHRNA6 Q15825 2/20 0.33
▸ HSD11B1 P28845 1/20 0.32
▸ PDE4B Q07343 2/20 0.31

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
SCHEMBL1711398 0.86 CHRNB2 (0.54) CHRNB2CHRNA4CHRNA3CHRNB4CHRNA7
SCHEMBL1711178 0.86 CHRNB2 (0.54) CHRNB2CHRNA4CHRNA3CHRNB4CHRNA7
SCHEMBL3241502 0.83 CHRNB2 (0.56) CHRNB2CHRNA4CHRNA3CHRNB4CHRNA7
SCHEMBL3236313 0.80 CHRNB2 (0.43) CHRNB2CHRNA4CHRNA3CHRNB4CHRNA7
SCHEMBL22001900 0.79 NR1H2 (0.43) CHRNB2CHRNA4CHRNA3CHRNB4CHRNA7
SCHEMBL22001901 0.79 NR1H2 (0.43) CHRNB2CHRNA4CHRNA3CHRNB4CHRNA7
SCHEMBL8102602 0.79 NR1H2 (0.43) CHRNB2CHRNA4CHRNA3CHRNB4CHRNA7
SCHEMBL13150517 0.79 CHRNB2 (0.44) CHRNB2CHRNA4CHRNA3CHRNB4CHRNA7
SCHEMBL3240417 0.77 CHRNB2 (0.52) CHRNB2CHRNA4CHRNA3CHRNB4CHRNA7
SCHEMBL3235786 0.77 CHRNB2 (0.40) CHRNB2CHRNA4CHRNA3CHRNB4CHRNA7

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
WO-2010028011-A1 AMIDES OF DIAZABICYCLONONANES AND USES THEREOF TARGACEPT, INC. (US) 2010-03-11 — — WO claimed
WO-2010028011-A1 AMIDES OF DIAZABICYCLONONANES AND USES THEREOF TARGACEPT, INC. (US) 2010-03-11 — — WO disclosed
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