SCHEMBL8294202

SCHEMBL8294202

CC1CCC([C@H](N)C(=O)N(C)C2CCC2)CC1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 9/20 0.36
DPP9 Q86TI2 3/20 0.36
LIPE Q05469 1/20 0.32
ALDH1A1 P00352 1/20 0.32
DPP8 Q6V1X1 3/20 0.32
DPP7 Q9UHL4 1/20 0.32
F2 P00734 1/20 0.31
ALOX5 P09917 1/20 0.31
FAAH O00519 1/20 0.31
PHGDH O43175 1/20 0.31
MGLL Q99685 1/20 0.31
ATM Q13315 1/20 0.30
KCNH2 Q12809 1/20 0.30
EPHX1 P07099 1/20 0.30
POLB P06746 1/20 0.30
SIGMAR1 Q99720 1/20 0.30

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
SCHEMBL8294319 1.00 DPP4 (0.36) DPP4DPP9LIPEALDH1A1DPP8
SCHEMBL8294342 0.87 DPP4 (0.40) DPP4DPP9ALDH1A1DPP7FAAH
SCHEMBL8294174 0.86 DPP4 (0.39) DPP4DPP9ALDH1A1DPP8DPP7
SCHEMBL8294301 0.86 DPP4 (0.42) DPP4DPP9ALDH1A1DPP8DPP7
SCHEMBL8296564 0.86 DPP4 (0.42) DPP4DPP9ALDH1A1DPP8DPP7
SCHEMBL8296704 0.86 DPP4 (0.42) DPP4DPP9ALDH1A1DPP8DPP7
Hydrochloric Acid SCHEMBL6243138 0.84 DPP4 (0.41) DPP4DPP9ALDH1A1DPP8DPP7
SCHEMBL6246057 0.83 ANPEP (0.35) DPP4DPP9ALDH1A1DPP8DPP7
SCHEMBL6246060 0.83 ANPEP (0.35) DPP4DPP9ALDH1A1DPP8DPP7
SCHEMBL8294193 0.82 DPP4 (0.42) DPP4DPP9ALDH1A1DPP8DPP7

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-2005025554-A2 DIPEPTIDYL PEPTIDASE IV INHIBITOR JAPAN TOBACCO INC. (JP) 2005-03-24 WO disclosed