SCHEMBL10900394

SCHEMBL10900394

NCCOC(OP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@H]1O[C@@H](n2ccc(N)nc2=O)C[C@@H]1O

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLG P54098 3/20 0.56
POLB P06746 1/20 0.52
P2RY2 P41231 8/20 0.48
P2RY4 P51582 4/20 0.48
P2RY6 Q15077 3/20 0.48
NT5E P21589 1/20 0.40
CACNA1F O60840 2/20 0.38
LMNA P02545 2/20 0.38
ALB P02768 2/20 0.38
MAPT P10636 2/20 0.38
CACNA1D Q01668 2/20 0.38
CACNA1S Q13698 2/20 0.38
CACNA1C Q13936 2/20 0.38
PDE3A Q14432 2/20 0.38
ST6GAL1 P15907 1/20 0.36

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
SCHEMBL4419522 0.89 POLG (0.61) POLGPOLBP2RY2P2RY4P2RY6
SCHEMBL9389237 0.88 POLG (0.55) POLGPOLBP2RY2P2RY4P2RY6
SCHEMBL585723 0.88 POLG (0.60) POLGPOLBP2RY2P2RY4P2RY6
SCHEMBL7520065 0.88 POLG (0.54) POLGPOLBP2RY2P2RY4P2RY6
SCHEMBL6914072 0.85 POLG (0.62) POLGPOLBP2RY2P2RY4P2RY6
SCHEMBL10903456 0.84 NT5E (0.55) POLGP2RY2P2RY4P2RY6NT5E
SCHEMBL17215882 0.84 POLG (0.61) POLGPOLBP2RY2P2RY4P2RY6
SCHEMBL1274297 0.84 POLG (0.72) POLGPOLBP2RY2P2RY4P2RY6
SCHEMBL4461899 0.84 POLG (0.61) POLGPOLBP2RY2P2RY4P2RY6
SCHEMBL5086151 0.81 POLG (0.56) POLGPOLBP2RY2P2RY4P2RY6

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
US-4587044-A Linkage of proteins to nucleic acids THE JOHNS HOPKINS UNIVERSITY (US) 1986-05-06 US disclosed