SCHEMBL14730360

SCHEMBL14730360

CCN(C(=O)c1cnc(N2C[C@H](c3cc(F)ccc3F)[C@@H](N)C2)nc1)C1CCN(c2nc(C3CC3)no2)CC1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 3/20 0.36
GPR119 Q8TDV5 2/20 0.35
DPP4 P27487 8/20 0.33
DPP8 Q6V1X1 5/20 0.33
DPP9 Q86TI2 4/20 0.33
KCNH2 Q12809 2/20 0.33
DPP7 Q9UHL4 5/20 0.33
TACR3 P29371 5/20 0.32
USP30 Q70CQ3 1/20 0.32
CYP2D6 P10635 1/20 0.32
CCR5 P51681 1/20 0.31

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
SCHEMBL14730248 0.94 PDK2 (0.35) MCHR1GPR119DPP4DPP8DPP9
SCHEMBL14730238 0.92 DPP4 (0.40) GPR119DPP4DPP8DPP9KCNH2
SCHEMBL14730184 0.92 GPR119 (0.36) MCHR1GPR119DPP4DPP8DPP9
SCHEMBL14730284 0.90 MCHR1 (0.36) MCHR1GPR119DPP4DPP8DPP9
SCHEMBL14730359 0.89 MCHR1 (0.36) MCHR1GPR119DPP4DPP8DPP9
SCHEMBL14730244 0.88 MCHR1 (0.35) MCHR1GPR119DPP4DPP8DPP9
SCHEMBL14730186 0.86 GPR119 (0.36) MCHR1GPR119DPP4DPP8DPP9
SCHEMBL14730371 0.84 MCHR1 (0.35) MCHR1GPR119DPP4DPP8DPP9
SCHEMBL14730361 0.84 GPR119 (0.35) GPR119DPP4DPP8KCNH2DPP7
SCHEMBL14730358 0.82 DPP4 (0.37) GPR119DPP4DPP8DPP9KCNH2

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-2013026587-A1 1,4 DISUBSTITUTED PYRROLIDINE - 3 - YL -AMINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF METABOLIC DISORDERS PROSIDION LIMITED (GB) 2013-02-28 WO disclosed