SCHEMBL22508591

SCHEMBL22508591

COP(=O)(O)OP(=O)(O)OC[C@@H]1C[C@H](O)C(n2ccc(N)nc2=O)O1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ P2RY2 P41231 7/20 0.54
▸ POLG P54098 1/20 0.52
▸ P2RY4 P51582 4/20 0.51
▸ P2RY6 Q15077 4/20 0.51
▸ POLB P06746 1/20 0.50
▸ TSHR P16473 1/20 0.45
▸ GLA P06280 1/20 0.45
▸ P2RY12 Q9H244 2/20 0.45
▸ P2RY14 Q15391 2/20 0.45
▸ POLA1 P09884 1/20 0.44

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
SCHEMBL22678641 0.91 POLG (0.62) P2RY2POLGP2RY4P2RY6POLB
SCHEMBL16807802 0.91 POLG (0.62) P2RY2POLGP2RY4P2RY6POLB
SCHEMBL6715777 0.91 POLG (0.62) P2RY2POLGP2RY4P2RY6POLB
SCHEMBL6715771 0.91 POLG (0.62) P2RY2POLGP2RY4P2RY6POLB
SCHEMBL6258019 0.91 POLG (0.59) P2RY2POLGP2RY4P2RY6POLB
SCHEMBL18383663 0.90 P2RY2 (0.53) P2RY2POLGP2RY4P2RY6POLB
SCHEMBL18102349 0.89 POLB (0.49) P2RY2POLGP2RY4P2RY6POLB
SCHEMBL21895965 0.87 POLB (0.56) P2RY2POLGP2RY4P2RY6POLB
SCHEMBL21896183 0.87 POLB (0.56) P2RY2POLGP2RY4P2RY6POLB
SCHEMBL12648719 0.87 POLB (0.56) P2RY2POLGP2RY4P2RY6POLB

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
EP-3947408-B1 SALT OF TRIPHOSPHATE PHOSPHORAMIDATES OF NUCLEOTIDES AS ANTICANCER COMPOUNDS NuCana plc (GB) 2023-06-07 — — EP disclosed
WO-2020201751-A1 SALT OF TRIPHOSPHATE PHOSPHORAMIDATES OF NUCLEOTIDES AS ANTICANCER COMPOUNDS NuCana plc (GB) 2020-10-08 — — WO disclosed
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