SCHEMBL2855452

SCHEMBL2855452

CC(C)(C)OC(=O)N1C[C@@H](N2CCN(c3ncccn3)CC2)C[C@H]1C(=O)N1CCSC1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.46
DPP4 P27487 16/20 0.44
FAAH O00519 1/20 0.43
MGLL Q99685 1/20 0.43
MAPT P10636 1/20 0.42
PREP P48147 1/20 0.42
DPP8 Q6V1X1 4/20 0.39
DPP7 Q9UHL4 3/20 0.39
KCNH2 Q12809 1/20 0.39
DPP9 Q86TI2 1/20 0.39

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
SCHEMBL2711647 0.90 DPP4 (0.58) GPR119DPP4DPP8DPP9
SCHEMBL2709916 0.87 DPP4 (0.46) DPP4KCNH2
SCHEMBL2708268 0.86 PREP (0.43) GPR119DPP4PREPDPP8DPP9
SCHEMBL2711368 0.86 DPP4 (0.56) DPP4PREPDPP8DPP9
SCHEMBL2711180 0.86 DPP4 (0.55) GPR119DPP4PREPDPP8KCNH2
SCHEMBL3839541 0.85 GPR119 (0.51) GPR119DPP4FAAHMGLLMAPT
SCHEMBL2707086 0.85 DPP4 (0.61) DPP4MAPTDPP8DPP7DPP9
SCHEMBL2709036 0.85 DPP4 (0.62) DPP4PREPDPP8DPP9
SCHEMBL2708993 0.85 DPP4 (0.58) DPP4PREPDPP8DPP9
SCHEMBL2711860 0.84 DPP4 (0.61) DPP4DPP8DPP9

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
US-7790725-B2 Thiazolidine derivatives and medicinal use thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-09-07 US disclosed