SCHEMBL8099472

SCHEMBL8099472

C=C(C)OC(=O)NC(C(=O)N1CCC[C@H]1C(N)=O)C1CC2CCCC(C1)N2C(=O)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 6/20 0.43
SPHK2 Q9NRA0 1/20 0.40
SPHK1 Q9NYA1 1/20 0.40
ELOVL6 Q9H5J4 1/20 0.37
GAA P10253 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
ELANE P08246 4/20 0.35
RAB9A P51151 1/20 0.35
SCN9A Q15858 2/20 0.34
FPR2 P25090 1/20 0.34
FAP Q12884 1/20 0.34
DPP8 Q6V1X1 1/20 0.34
DPP9 Q86TI2 1/20 0.34
DPP7 Q9UHL4 1/20 0.34
PDK2 Q15119 1/20 0.34
F2 P00734 1/20 0.33
PTGER4 P35408 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
SCHEMBL3800885 0.89 DPP4 (0.44) DPP4SPHK2SPHK1ELOVL6GAA
SCHEMBL8101422 0.86 DPP4 (0.45) DPP4SPHK2SPHK1ELOVL6GAA
SCHEMBL3741039 0.79 CMA1 (0.44) DPP4ELOVL6ELANE
SCHEMBL13078816 0.78 ELOVL6 (0.40) DPP4ELOVL6GAATDP1RAB9A
SCHEMBL3747942 0.78 KLK5 (0.44) DPP4ELOVL6GAATDP1ELANE
SCHEMBL3802747 0.76 DPP4 (0.52) DPP4ELOVL6FAPDPP8DPP9
Trifluoroacetic Acid SCHEMBL3742689 0.75 DPP4 (0.46) DPP4SPHK2SPHK1ELOVL6GAA
SCHEMBL3744756 0.74 ELOVL6 (0.40) DPP4ELOVL6GAATDP1FAP
SCHEMBL13045313 0.74 PEPD (0.46) DPP4SPHK2SPHK1ELOVL6GAA
SCHEMBL3749600 0.74 ELOVL6 (0.39) DPP4SPHK2SPHK1ELOVL6GAA

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-2009037719-A1 NOVEL COMPOUNDS AS DIPEPTIDYL PEPTIDASE IV (DPP IV) INHIBITORS LUPIN LIMITED (IN) 2009-03-26 WO disclosed