SCHEMBL650346

SCHEMBL650346

CC(C)(C)OC(=O)N1CC[C@H]2CN(c3ccc(Cl)nc3)[C@H]2C1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 4/20 0.48
CHRNB4 P30926 4/20 0.48
CHRNA3 P32297 4/20 0.48
CHRNA4 P43681 4/20 0.48
GPR119 Q8TDV5 12/20 0.47
USP30 Q70CQ3 3/20 0.45
MEN1 O00255 1/20 0.43
USP2 O75604 1/20 0.43
HPGD P15428 1/20 0.43
KMT2A Q03164 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
HSD17B10 Q99714 1/20 0.43

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
SCHEMBL652549 1.00 CHRNB2 (0.48) CHRNB2CHRNB4CHRNA3CHRNA4GPR119
SCHEMBL650888 0.92 GPR119 (0.47) CHRNB2CHRNB4CHRNA3CHRNA4GPR119
SCHEMBL653024 0.92 GPR119 (0.47) CHRNB2CHRNB4CHRNA3CHRNA4GPR119
SCHEMBL649953 0.92 GPR119 (0.47) CHRNB2CHRNB4CHRNA3CHRNA4GPR119
SCHEMBL653184 0.84 CHRNB2 (0.49) CHRNB2CHRNB4CHRNA3CHRNA4GPR119
SCHEMBL652111 0.84 CHRNB2 (0.49) CHRNB2CHRNB4CHRNA3CHRNA4GPR119
SCHEMBL31247616 0.84 GPR119 (0.52) GPR119MEN1KMT2A
SCHEMBL652318 0.83 CHRNB2 (0.52) CHRNB2CHRNB4CHRNA3CHRNA4GPR119
SCHEMBL654118 0.83 CHRNB2 (0.52) CHRNB2CHRNB4CHRNA3CHRNA4GPR119
SCHEMBL3572727 0.83 CHRNB2 (0.55) CHRNB2CHRNB4CHRNA3CHRNA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8119635-B2 Diazabicyclic central nervous system active agents ABBOTT LABORATORIES (US) 2012-02-21 US disclosed
EP-2298775-A1 Diazabicyclic central nervous system active agents Abbott Laboratories (US) 2011-03-23 EP disclosed
EP-2295437-A1 Diazabicyclic central nervous system active agents Abbott Laboratories (US) 2011-03-16 EP disclosed