SCHEMBL3671964

SCHEMBL3671964

CCc1cn(C2O[C@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]c1=O

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PYGM P11217 3/20 0.69
TK2 O00142 5/20 0.63
DNPH1 O43598 1/20 0.60
SLC28A1 O00337 1/20 0.59
SLC28A2 O43868 1/20 0.59
SLC29A1 Q99808 1/20 0.59
SLC28A3 Q9HAS3 1/20 0.59
TK1 P04183 1/20 0.53
SLC5A2 P31639 1/20 0.51
P2RY2 P41231 3/20 0.50
TSHR P16473 1/20 0.49
LMNA P02545 1/20 0.49
MAPT P10636 1/20 0.49
PMP22 Q01453 1/20 0.49
HBB P68871 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49

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
SCHEMBL1286250 1.00 PYGM (0.69) PYGMTK2DNPH1SLC28A1SLC28A2
SCHEMBL16808996 1.00 PYGM (0.69) PYGMTK2DNPH1SLC28A1SLC28A2
SCHEMBL2577325 1.00 PYGM (0.69) PYGMTK2DNPH1SLC28A1SLC28A2
SCHEMBL1286252 1.00 PYGM (0.69) PYGMTK2DNPH1SLC28A1SLC28A2
SCHEMBL3385371 1.00 PYGM (0.69) PYGMTK2DNPH1SLC28A1SLC28A2
SCHEMBL1272640 0.91 TK2 (0.65) PYGMTK2DNPH1SLC28A1SLC28A2
SCHEMBL2583312 0.91 TK2 (0.65) PYGMTK2DNPH1SLC28A1SLC28A2
SCHEMBL3416516 0.91 TK2 (0.65) PYGMTK2DNPH1SLC28A1SLC28A2
SCHEMBL1272642 0.91 TK2 (0.65) PYGMTK2DNPH1SLC28A1SLC28A2
SCHEMBL14929135 0.91 DNPH1 (0.71) PYGMTK2DNPH1SLC28A1SLC28A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2242516-A1 METHODS AND COMPOSITIONS FOR DETECTION OF BACTERIA AND TREATMENT OF DISEASES AND DISORDERS Genelux Corporation (US) 2010-10-27 EP disclosed
WO-2009126189-A1 METHODS AND COMPOSITIONS FOR DETECTION OF BACTERIA AND TREATMENT OF DISEASES AND DISORDERS GENELUX CORPORATION (US) 2009-10-15 WO disclosed
EP-1768704-A2 IMAGING INFECTION WITH COMPOUNDS THAT BIND TO THYMIDINE KINASE The Johns Hopkins University (US) 2007-04-04 EP disclosed
WO-2006002142-A2 IMAGING INFECTION WITH COMPOUNDS THAT BIND TO THYMIDINE KINASE THE JOHNS HOPKINS UNIVERSITY (US) 2006-01-05 WO disclosed