SCHEMBL6672053

SCHEMBL6672053

NC(=O)C(Cc1cscn1)OC(=O)CC(=O)OC(Cc1cscn1)C(N)=O

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.36
DPP8 Q6V1X1 2/20 0.36
DPP9 Q86TI2 2/20 0.36
GPR142 Q7Z601 5/20 0.36
CAPN1 P07384 1/20 0.34
FOLH1 Q04609 1/20 0.34
KDM4C Q9H3R0 1/20 0.34
CTSK P43235 2/20 0.34
PKM P14618 1/20 0.33
SYK P43405 1/20 0.33
MAPK1 P28482 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
SLC6A3 Q01959 1/20 0.32
CTSB P07858 1/20 0.32
CTSS P25774 1/20 0.32
KLKB1 P03952 2/20 0.32
OPRD1 P41143 1/20 0.31
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL5207691 0.74 DPP4 (0.49) DPP4DPP8DPP9GPR142CAPN1
SCHEMBL7401594 0.74 DPP4 (0.49) DPP4DPP8DPP9GPR142CAPN1
SCHEMBL7337840 0.74 CAPN1 (0.41) DPP4DPP8DPP9GPR142CAPN1
SCHEMBL5795615 0.73 DPP4 (0.40) DPP4DPP8DPP9GPR142CAPN1
SCHEMBL7275102 0.73 KDM4E (0.40) DPP4DPP8DPP9GPR142CAPN1
SCHEMBL9565308 0.72 KDM4E (0.44) DPP4DPP8DPP9GPR142CAPN1
SCHEMBL21216051 0.72 PPARG (0.40) DPP4DPP8DPP9GPR142CAPN1
SCHEMBL990478 0.71 DPP4 (0.49) DPP4DPP8DPP9GPR142PKM
SCHEMBL5907044 0.71 DPP4 (0.49) DPP4DPP8DPP9GPR142PKM
SCHEMBL9079440 0.71 DPP4 (0.38) DPP4DPP8DPP9GPR142CAPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1069118-B1 PROCESS FOR PRODUCING 4-THIAZOLYLMETHYL DERIVATIVE SHIONOGI & CO (JP) 2004-09-22 EP disclosed
US-6506903-B1 By reacting 4-methylthiazole with N-halosuccinimide in solvent in presence of 2,2-azobisisobutyronitrile; halogenation, catalysis SHIONOGI & CO., LTD. (JP) 2003-01-14 US disclosed
EP-1069118-A1 PROCESS FOR PRODUCING 4-THIAZOLYLMETHYL DERIVATIVE SHIONOGI & CO., LTD. (JP) 2001-01-17 EP disclosed