SCHEMBL2739682

SCHEMBL2739682

C[C@H](C=O)NC(=O)[C@@H](N)CN

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DPP9 Q86TI2 10/20 0.44
DPP4 P27487 8/20 0.44
DPP7 Q9UHL4 8/20 0.44
PAX8 Q06710 1/20 0.38
DPP8 Q6V1X1 9/20 0.35
SLC15A1 P46059 1/20 0.34
CTSK P43235 1/20 0.31
SLC7A5 Q01650 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
SCHEMBL2739683 1.00 DPP9 (0.44) DPP9DPP4DPP7PAX8DPP8
SCHEMBL10067240 1.00 DPP9 (0.44) DPP9DPP4DPP7PAX8DPP8
SCHEMBL1031741 0.84 PAX8 (0.45) DPP9DPP4DPP7PAX8DPP8
SCHEMBL8560140 0.84 PAX8 (0.45) DPP9DPP4DPP7PAX8DPP8
SCHEMBL16421636 0.82 PAX8 (0.37) DPP9DPP4DPP7PAX8DPP8
SCHEMBL25587465 0.82 SLC7A5 (0.47) PAX8CTSKSLC7A5
SCHEMBL14623137 0.81 DPP9 (0.41) DPP9DPP4DPP7PAX8DPP8
SCHEMBL24221417 0.79 DPP9 (0.49) DPP9DPP4DPP7DPP8SLC15A1
SCHEMBL1036161 0.79 DPP4 (0.50) DPP9DPP4DPP7PAX8DPP8
SCHEMBL14151828 0.79 DPP4 (0.50) DPP9DPP4DPP7PAX8DPP8

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1863832-B1 AGE INHIBITORS CENTRE NAT RECH SCIENT (FR) 2012-01-04 EP disclosed
WO-2006103274-A9 AGE INHIBITORS PHARMAMENS (FR) 2007-01-18 WO disclosed