SCHEMBL6524202

SCHEMBL6524202

NP(O)OC[C@H]1O[C@@H](n2ccc(NC(=O)c3ccccc3)nc2=O)C[C@@H]1O

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.63
ABL1 P00519 1/20 0.56
RIN1 Q13671 1/20 0.56
P2RY6 Q15077 4/20 0.51
P2RY14 Q15391 2/20 0.51
NT5E P21589 2/20 0.51
P2RY2 P41231 3/20 0.41
P2RY4 P51582 3/20 0.41
P2RY12 Q9H244 1/20 0.40
ST6GAL1 P15907 1/20 0.39
DUT P33316 1/20 0.39
PLA2G1B P04054 1/20 0.39
ATG4B Q9Y4P1 1/20 0.39

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
SCHEMBL6524192 0.89 POLB (0.70) POLBABL1RIN1P2RY6P2RY14
SCHEMBL13170031 0.89 POLB (0.69) POLBABL1RIN1P2RY6P2RY14
SCHEMBL19662634 0.88 POLB (0.66) POLBABL1RIN1P2RY6P2RY14
SCHEMBL9341119 0.87 POLB (0.66) POLBABL1RIN1P2RY6P2RY14
SCHEMBL9341126 0.87 POLB (0.66) POLBABL1RIN1P2RY6P2RY14
SCHEMBL264065 0.86 POLB (0.76) POLBABL1RIN1P2RY6P2RY14
SCHEMBL28795634 0.86 POLB (0.76) POLBABL1RIN1P2RY6P2RY14
SCHEMBL264066 0.86 POLB (0.76) POLBABL1RIN1P2RY6P2RY14
SCHEMBL14733368 0.86 POLB (0.76) POLBABL1RIN1P2RY6P2RY14
SCHEMBL26398390 0.85 POLB (0.66) POLBABL1RIN1P2RY6P2RY14

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-20050181384-A1 Selectivity of nucleic acid diagnostic and microarray technologies by control of interfacial nucleic acid film chemistry PIUNNO PAUL A (CA) 2005-08-18 US disclosed
US-20020137074-A1 Selectivity of nucleic acid diagnostic and microarray technologies by control of interfacial nucleic acid film chemistry PIUNNO PAUL A E (CA) 2002-09-26 US disclosed