SCHEMBL3225870

SCHEMBL3225870

CCCNC(=O)N1CC2CCC(C1)NC2

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
CHRNB2 P17787 6/20 0.40
CHRNA3 P32297 6/20 0.40
CHRNA4 P43681 6/20 0.40
CHRNB4 P30926 5/20 0.40
CHRNA7 P36544 5/20 0.40
KMT2A Q03164 4/20 0.38
CYP2C19 P33261 2/20 0.37
MEN1 O00255 2/20 0.37
CYP2C9 P11712 1/20 0.37
CHRM1 P11229 1/20 0.34
NAMPT P43490 2/20 0.33
CHRNB3 Q05901 1/20 0.33
CHRNA6 Q15825 1/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL3233246 0.92 HTT (0.43) LMNACHRNB2CHRNA3CHRNA4CHRNB4
SCHEMBL3235821 0.90 KMT2A (0.46) LMNACHRNB2CHRNA3CHRNA4CHRNB4
SCHEMBL3236377 0.80 CHRNB2 (0.45) CHRNB2CHRNA3CHRNA4CHRNB4CHRNA7
SCHEMBL3228729 0.78 CHRNB2 (0.58) CHRNB2CHRNA3CHRNA4CHRNB4CHRNA7
SCHEMBL3236539 0.77 CHRNB2 (0.56) CHRNB2CHRNA3CHRNA4CHRNB4CHRNA7
SCHEMBL1711252 0.76 CHRNB2 (0.55) CHRNB2CHRNA3CHRNA4CHRNB4CHRNA7
SCHEMBL3240417 0.75 CHRNB2 (0.52) CHRNB2CHRNA3CHRNA4CHRNB4CHRNA7
SCHEMBL3236313 0.75 CHRNB2 (0.43) CHRNB2CHRNA3CHRNA4CHRNB4CHRNA7
SCHEMBL3235786 0.74 CHRNB2 (0.40) LMNACHRNB2CHRNA3CHRNA4CHRNB4
SCHEMBL3241502 0.74 CHRNB2 (0.56) CHRNB2CHRNA3CHRNA4CHRNB4CHRNA7

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