SCHEMBL17100549

SCHEMBL17100549

CCC[C@H](N)C(=O)N[C@@H](C)[C]=O

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 11/20 0.50
DPP9 Q86TI2 10/20 0.50
DPP8 Q6V1X1 10/20 0.50
DPP4 P27487 8/20 0.50
SLC15A1 P46059 1/20 0.43
RRM1 P23921 1/20 0.37
HDAC7 Q8WUI4 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
HDAC9 Q9UKV0 1/20 0.35
HDAC5 Q9UQL6 1/20 0.35
CTSB P07858 1/20 0.35
CTSH P09668 1/20 0.35
CTSS P25774 1/20 0.35
CTSK P43235 1/20 0.35
CTSC P53634 1/20 0.35

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
SCHEMBL27262388 0.82 DPP4 (0.61) DPP9DPP8DPP4CTSC
SCHEMBL10703971 0.82 DPP7 (0.51) DPP7DPP9DPP8DPP4SLC15A1
SCHEMBL10943106 0.82 DPP4 (0.61) DPP9DPP8DPP4CTSC
SCHEMBL8991404 0.81 DPP7 (0.50) DPP7DPP9DPP8DPP4SLC15A1
SCHEMBL9797628 0.81 DPP7 (0.50) DPP7DPP9DPP8DPP4SLC15A1
SCHEMBL1031740 0.81 DPP4 (0.38) DPP7DPP9DPP8DPP4
SCHEMBL9352805 0.81 CTSC (0.41) DPP7DPP9DPP8DPP4CTSC
SCHEMBL5671395 0.81 DPP8 (0.52) DPP7DPP9DPP8DPP4SLC15A1
SCHEMBL9117592 0.81 DPP8 (0.52) DPP7DPP9DPP8DPP4SLC15A1
SCHEMBL9117596 0.81 DPP8 (0.52) DPP7DPP9DPP8DPP4SLC15A1

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-3119799-A1 ANTIMICROBIAL COMPOUNDS Biomérieux (FR) 2017-01-25 EP disclosed
WO-2015140481-A1 ANTIMICROBIAL COMPOUNDS bioMérieux (FR) 2015-09-24 WO disclosed