SCHEMBL6510648

SCHEMBL6510648

CC(C)(C)NCC(=O)N1CCCC1C(=O)c1noc(C2(C)CC2)n1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 17/20 0.61
DPP8 Q6V1X1 11/20 0.61
DPP7 Q9UHL4 11/20 0.61
DPP9 Q86TI2 2/20 0.42
CNR2 P34972 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
SCHEMBL6532358 0.91 DPP4 (0.74) DPP4DPP8DPP7DPP9
SCHEMBL6514705 0.86 DPP4 (0.60) DPP4DPP8DPP7DPP9
SCHEMBL6533584 0.84 DPP4 (0.82) DPP4DPP8DPP7DPP9
SCHEMBL6531210 0.83 DPP4 (0.55) DPP4DPP8DPP7DPP9CNR2
SCHEMBL6514688 0.82 DPP4 (0.64) DPP4DPP8DPP7DPP9
SCHEMBL6528448 0.82 DPP4 (0.54) DPP4DPP8DPP7DPP9CNR2
SCHEMBL6510062 0.82 DPP4 (0.63) DPP4DPP8DPP7DPP9
SCHEMBL6517772 0.82 DPP4 (0.59) DPP4DPP8DPP7DPP9
SCHEMBL6528683 0.81 DPP4 (0.54) DPP4DPP8DPP7DPP9CNR2
SCHEMBL6532093 0.81 HSD17B10 (0.45) DPP4DPP8DPP7

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