SCHEMBL6692145

SCHEMBL6692145

N#C[C@@H]1CCCN1C(=O)C[C@H](CCc1ccccc1)NC(=O)O

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 14/20 0.62
PREP P48147 6/20 0.60
DPP8 Q6V1X1 6/20 0.55
DPP7 Q9UHL4 3/20 0.55
DPP9 Q86TI2 1/20 0.53

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
SCHEMBL6685012 1.00 DPP4 (0.62) DPP4PREPDPP8DPP7DPP9
SCHEMBL6685006 1.00 DPP4 (0.62) DPP4PREPDPP8DPP7DPP9
SCHEMBL6686205 0.84 DPP4 (0.62) DPP4PREPDPP8DPP7DPP9
SCHEMBL6692186 0.84 DPP4 (0.62) DPP4PREPDPP8DPP7DPP9
SCHEMBL6687259 0.82 ACE (0.52) DPP4
SCHEMBL6687254 0.82 ACE (0.52) DPP4
SCHEMBL6687452 0.82 ACE (0.52) DPP4
SCHEMBL6688921 0.75 DPP4 (0.63) DPP4PREPDPP8DPP7DPP9
SCHEMBL6686177 0.75 DPP4 (0.55) DPP4PREPDPP8DPP7
SCHEMBL6688053 0.74 DPP4 (0.64) DPP4PREPDPP8DPP7DPP9

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-2004089362-A1 2-CYANOPYRROLES AND THEIR ANALOGUES AS DDP-IV INHIBITORS NOVO NORDISK A/S (DK) 2004-10-21 WO disclosed