SCHEMBL11478249

SCHEMBL11478249

Nc1nc([C@@H]2O[C@H](C(O)OP(=O)(O)O)[C@@H](O)[C@@H]2O)nc2nc[nH]c12

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.36
GDA Q9Y2T3 1/20 0.36
KDR P35968 1/20 0.34
AURKB Q96GD4 1/20 0.34
MGMT P16455 2/20 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
SCHEMBL3150893 1.00 PDPK1 (0.36) PDPK1GDAKDRAURKBMGMT
SCHEMBL11468514 1.00 PDPK1 (0.36) PDPK1GDAKDRAURKBMGMT
Phosphoric Acid SCHEMBL1130273 0.77 PDPK1 (0.39) PDPK1GDAKDRAURKB
SCHEMBL11875859 0.75
SCHEMBL8102858 0.73 ADORA1 (0.43) PDPK1GDAKDRAURKB
SCHEMBL9393271 0.72 PDPK1 (0.43) PDPK1GDAKDRAURKB
SCHEMBL240029 0.72 PDPK1 (0.43) PDPK1GDAKDRAURKB
SCHEMBL4436406 0.72 PDPK1 (0.43) PDPK1GDAKDRAURKB
SCHEMBL2636634 0.72 PDPK1 (0.43) PDPK1GDAKDRAURKB
SCHEMBL2010793 0.72 PDPK1 (0.43) PDPK1GDAKDRAURKB

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
EP-0015584-A2 Nucleotides, methods for their preparation and medicaments Gauri, Kailash Kumar, Dr. Prof. (DE) 1980-09-17 EP disclosed