SCHEMBL5693531

SCHEMBL5693531

CC(=O)NC(CN)(NC(C)=O)NC(C)=O

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 2/20 0.34
KDM4E B2RXH2 4/20 0.34
PKM P14618 2/20 0.34
THRB P10828 1/20 0.33
CA2 P00918 1/20 0.33
PTGS1 P23219 1/20 0.33
MMP12 P39900 1/20 0.33
CRBN Q96SW2 1/20 0.33
HTT P42858 1/20 0.32
NFKB1 P19838 1/20 0.32
EPHX1 P07099 1/20 0.31
TAS2R38 P59533 1/20 0.31
MAPK1 P28482 1/20 0.31
HIF1A Q16665 1/20 0.31
LMNA P02545 1/20 0.30
ALOX15 P16050 1/20 0.30
BLM P54132 1/20 0.30
PMP22 Q01453 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
SCHEMBL11032929 0.76
SCHEMBL28826612 0.72 KDM4E (0.34) KDM4EPKMTHRBCA2PTGS1
SCHEMBL23366826 0.69 KDM4E (0.35) KDM4EEPHX1
SCHEMBL23366825 0.67 TDP1 (0.33) KDM4ECRBN
SCHEMBL31617030 0.67 PKM (0.38) KDM4EPKMTHRBCA2PTGS1
SCHEMBL7129495 0.65
SCHEMBL7128936 0.63
SCHEMBL24820865 0.63 POLB (0.34) KDM4EPKMTHRBCA2PTGS1
SCHEMBL124179 0.63
SCHEMBL27265453 0.63 EPHX1 (0.42) KDM4EPKMTHRBCA2PTGS1

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-0684843-B1 TECHNETIUM-99m LABELED PEPTIDES FOR DIAGNOSTIC IMAGING OF INFLAMMATION DIATIDE INC (US) 2006-05-10 EP claimed
EP-0684843-B1 TECHNETIUM-99m LABELED PEPTIDES FOR DIAGNOSTIC IMAGING OF INFLAMMATION DIATIDE INC (US) 2006-05-10 EP disclosed
US-6107459-A REAGENT WHICH BINDS TO SITES OF INFECTION, INFLAMMATION, THROMBOSIS, ATHEROSCLEROSIS AND NEOPLASTIC GROWTH IN VIVO DIATIDE, INC. (US) 2000-08-22 US disclosed