SCHEMBL13679232

SCHEMBL13679232

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 5/20 0.36
SLC15A1 P46059 1/20 0.36
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
CTSS P25774 1/20 0.35
CTSK P43235 1/20 0.35
ANPEP P15144 1/20 0.34
DNPEP Q9ULA0 1/20 0.34
DPP8 Q6V1X1 3/20 0.33
RRM1 P23921 1/20 0.33
DPP4 P27487 2/20 0.33
DPP9 Q86TI2 2/20 0.33
GABRP O00591 2/20 0.32
GABRD O14764 2/20 0.32
GABRA1 P14867 2/20 0.32
GABRB1 P18505 2/20 0.32
GABRG2 P18507 2/20 0.32

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
SCHEMBL13958540 0.80 HDAC7 (0.40) DPP7HDAC7HDAC8HDAC6HDAC9
SCHEMBL6848366 0.80 HDAC7 (0.40) DPP7HDAC7HDAC8HDAC6HDAC9
SCHEMBL13227770 0.76 HDAC7 (0.43) HDAC7HDAC8HDAC6HDAC9HDAC5
SCHEMBL25719293 0.76 HDAC7 (0.43) HDAC7HDAC8HDAC6HDAC9HDAC5
SCHEMBL12766447 0.76 HDAC7 (0.36) DPP7HDAC7HDAC8HDAC6HDAC9
SCHEMBL22175192 0.76 TDP1 (0.47) HDAC7HDAC8HDAC6HDAC9HDAC5
SCHEMBL22622376 0.74 HDAC7 (0.35) HDAC7HDAC8HDAC6HDAC9HDAC5
SCHEMBL18964732 0.74 SIRT6 (0.38) DPP7HDAC7HDAC8HDAC6HDAC9
SCHEMBL11652880 0.73 ANPEP (0.37) DPP7SLC15A1ANPEPDNPEPDPP4
SCHEMBL3867719 0.71

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
EP-2103619-A1 IMIDAZOTHIAZOLE DERIVATIVES Daiichi Sankyo Company, Limited (JP) 2009-09-23 EP disclosed