SCHEMBL6992485

SCHEMBL6992485

CC(C)(CNc1ccc(S(=O)(=O)N2CCOCC2)cn1)NCC(=O)N1CCCC1C#N

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 17/20 0.68
KDM4E B2RXH2 1/20 0.51
TSHR P16473 1/20 0.51
HSD17B10 Q99714 1/20 0.51
DPP7 Q9UHL4 2/20 0.49
DPP8 Q6V1X1 1/20 0.49

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
SCHEMBL6701155 1.00 DPP4 (0.68) DPP4KDM4ETSHRHSD17B10DPP7
SCHEMBL6703809 0.93 DPP4 (0.71) DPP4DPP7DPP8
SCHEMBL6993334 0.90 DPP4 (0.70) DPP4DPP7DPP8
SCHEMBL6699425 0.88 DPP4 (0.69) DPP4DPP7DPP8
SCHEMBL464911 0.85 DPP4 (0.72) DPP4DPP7DPP8
SCHEMBL6989649 0.84 DPP4 (0.70) DPP4DPP7DPP8
SCHEMBL6989341 0.84 DPP4 (0.70) DPP4DPP7DPP8
SCHEMBL6995413 0.84 DPP4 (0.70) DPP4DPP7DPP8
SCHEMBL6702197 0.84 DPP4 (0.70) DPP4DPP7DPP8
SCHEMBL6991610 0.83 DPP4 (0.69) DPP4DPP7DPP8

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
EP-1354882-A1 DIPEPTIDYL PEPTIDASE IV INHIBITOR KYOWA HAKKO KOGYO CO., LTD. (JP) 2003-10-22 EP disclosed