SCHEMBL18512922

SCHEMBL18512922

CNCc1cn(C2OC(CO)C(O)C2O)c(=O)[nH]c1=O

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PYGM P11217 3/20 0.63
TK2 O00142 3/20 0.58
DNPH1 O43598 1/20 0.55
SLC28A1 O00337 1/20 0.54
SLC28A2 O43868 1/20 0.54
SLC29A1 Q99808 1/20 0.54
SLC28A3 Q9HAS3 1/20 0.54
P2RY2 P41231 5/20 0.51
TK1 P04183 1/20 0.47
TSHR P16473 1/20 0.45
LMNA P02545 1/20 0.45
MAPT P10636 1/20 0.45
PMP22 Q01453 1/20 0.45
HBB P68871 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL41007 1.00 PYGM (0.63) PYGMTK2DNPH1SLC28A1SLC28A2
SCHEMBL14853801 1.00 PYGM (0.63) PYGMTK2DNPH1SLC28A1SLC28A2
SCHEMBL18503552 1.00 PYGM (0.63) PYGMTK2DNPH1SLC28A1SLC28A2
SCHEMBL41006 1.00 PYGM (0.63) PYGMTK2DNPH1SLC28A1SLC28A2
SCHEMBL14929134 1.00 PYGM (0.63) PYGMTK2DNPH1SLC28A1SLC28A2
SCHEMBL157586 0.88 PYGM (0.52) PYGMTK2DNPH1SLC28A1SLC28A2
SCHEMBL157193 0.88 PYGM (0.49) PYGMTK2DNPH1SLC28A1SLC28A2
SCHEMBL157587 0.88 PYGM (0.52) PYGMTK2DNPH1SLC28A1SLC28A2
SCHEMBL216337 0.88 PYGM (0.61) PYGMTK2DNPH1SLC28A1SLC28A2
SCHEMBL157194 0.88 PYGM (0.49) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11339441-B2 Profiling chemically modified DNA/RNA units for disease and cancer diagnosis THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2022-05-24 US disclosed
US-20170044619-A1 PROFILING CHEMICALLY MODIFIED DNA/RNA UNITS FOR DISEASE AND CANCER DIAGNOSIS THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK 2017-02-16 US disclosed