SCHEMBL14730290

SCHEMBL14730290

CO[C@@H](C)c1noc(N2CCC(N(C)C(=O)c3cnc(N4C[C@H](c5cc(C)ccc5F)[C@@H](N)C4)nc3)CC2)n1

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 7/20 0.32
DPP4 P27487 7/20 0.32
MAPT P10636 2/20 0.32
LMNA P02545 1/20 0.32
DPP8 Q6V1X1 5/20 0.32
DPP7 Q9UHL4 5/20 0.32
DPP9 Q86TI2 4/20 0.32
MCHR1 Q99705 1/20 0.32
KCNH2 Q12809 2/20 0.31
CCR5 P51681 1/20 0.30
TP53 P04637 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
SCHEMBL14730363 0.93 GPR119 (0.36) GPR119DPP4MAPTLMNADPP8
SCHEMBL14730186 0.87 GPR119 (0.36) GPR119DPP4MAPTLMNADPP8
SCHEMBL14730242 0.86 ALOX5AP (0.36) GPR119DPP4DPP8DPP7DPP9
SCHEMBL14730361 0.85 GPR119 (0.35) GPR119DPP4MAPTLMNADPP8
SCHEMBL14730286 0.84 GPR119 (0.37) GPR119DPP4DPP8DPP7DPP9
SCHEMBL14730293 0.83 DPP4 (0.32) DPP4DPP8DPP7DPP9MCHR1
SCHEMBL14730288 0.83 DPP4 (0.41) DPP4DPP8DPP7DPP9KCNH2
SCHEMBL14730230 0.83 DPP4 (0.38) DPP4DPP8DPP7DPP9KCNH2
SCHEMBL14730357 0.83 DPP4 (0.36) DPP4DPP8DPP7DPP9KCNH2
SCHEMBL14730299 0.81 DPP4 (0.37) GPR119DPP4DPP8DPP7DPP9

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