SCHEMBL6528825

SCHEMBL6528825

CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)c1noc(-c2ccc(F)cc2)n1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 5/20 0.47
DPP4 P27487 4/20 0.43
DPP8 Q6V1X1 3/20 0.43
DPP7 Q9UHL4 3/20 0.43
GPR119 Q8TDV5 1/20 0.43
NPC1 O15118 1/20 0.42
UCHL1 P09936 2/20 0.42
HSD17B10 Q99714 1/20 0.42
LMNA P02545 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
GRM5 P41594 1/20 0.41
EPHX2 P34913 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL6532469 0.82 USP30 (0.45) USP30NPC1UCHL1EPHX2MEN1
SCHEMBL6519353 0.82 DPP4 (0.58) DPP4DPP8DPP7GRM5
SCHEMBL6530003 0.80 DPP4 (0.58) DPP4DPP8DPP7
SCHEMBL6527845 0.80 DPP4 (0.61) USP30DPP4DPP8DPP7GPR119
SCHEMBL6529796 0.80 DPP4 (0.69) DPP4DPP8DPP7
SCHEMBL6533019 0.79 DPP4 (0.61) USP30DPP4DPP8DPP7NPC1
SCHEMBL10132243 0.79 NPC1 (0.58) USP30NPC1UCHL1HSD17B10LMNA
SCHEMBL6532079 0.78 HSD17B10 (0.47) USP30DPP4DPP8DPP7NPC1
SCHEMBL6530702 0.77 HSD17B10 (0.46) USP30DPP4DPP8DPP7NPC1
SCHEMBL6528322 0.77 ALDH1A1 (0.48) USP30DPP4DPP8DPP7NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005037828-A1 NOVEL INHIBITORS OF DPP-IV, METHODS OF PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AS AN ACTIVE AGENT LG LIFE SCIENCES LTD. (KR) 2005-04-28 WO disclosed