SCHEMBL3233246

SCHEMBL3233246

CCCCNC(=O)N1CC2CCC(C1)NC2

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.43
TDP1 Q9NUW8 1/20 0.42
NAMPT P43490 2/20 0.40
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
CHRNB2 P17787 3/20 0.38
CHRNB4 P30926 3/20 0.38
CHRNA3 P32297 3/20 0.38
CHRNA7 P36544 3/20 0.38
CHRNA4 P43681 3/20 0.38
POLB P06746 1/20 0.38
PRCP P42785 1/20 0.38
LMNA P02545 1/20 0.36
PKM P14618 1/20 0.36
GAA P10253 1/20 0.36
L3MBTL1 Q9Y468 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
SCHEMBL3225870 0.92 LMNA (0.44) HTTNAMPTKMT2AMEN1CHRNB2
SCHEMBL3235821 0.87 KMT2A (0.46) HTTKMT2ACHRNB2CHRNB4CHRNA3
SCHEMBL3236377 0.78 CHRNB2 (0.45) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL3228729 0.76 CHRNB2 (0.58) KMT2AMEN1CHRNB2CHRNB4CHRNA3
SCHEMBL3236539 0.75 CHRNB2 (0.56) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL1711252 0.74 CHRNB2 (0.55) HTTKMT2ACHRNB2CHRNB4CHRNA3
SCHEMBL8312649 0.73 HTT (0.56) HTTTDP1NAMPTKMT2AMEN1
SCHEMBL3240417 0.73 CHRNB2 (0.52) KMT2AMEN1CHRNB2CHRNB4CHRNA3
SCHEMBL3236313 0.73 CHRNB2 (0.43) HTTKMT2AMEN1CHRNB2CHRNB4
SCHEMBL3235786 0.72 CHRNB2 (0.40) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4

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