SCHEMBL24081859

SCHEMBL24081859

C#C[C@H]1C[C@@H](COP(=O)(O)O)O[C@H]1Cn1cnc2c(=O)[nH]c(N)nc21

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PNP P00491 7/20 0.51
▸ POLB P06746 3/20 0.48
▸ HPRT1 P00492 10/20 0.48
▸ POLG P54098 2/20 0.47
▸ POLA1 P09884 1/20 0.47

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
SCHEMBL23760838 0.84 NT5E (0.54) PNPPOLBHPRT1
SCHEMBL24081863 0.77 FUT5 (0.55) PNPPOLBPOLGPOLA1
SCHEMBL20879415 0.76 POLG (0.64) PNPPOLBHPRT1POLGPOLA1
SCHEMBL26208657 0.75 NT5E (0.67) POLB
SCHEMBL20698981 0.75 NT5E (0.57) PNPPOLBHPRT1
SCHEMBL2922052 0.75 POLB (0.61) PNPPOLB
SCHEMBL20442307 0.75 POLB (0.61) PNPPOLB
SCHEMBL13619242 0.75 PNP (0.79) PNPPOLBHPRT1POLG
SCHEMBL21636997 0.74 NT5E (0.56) PNPPOLBHPRT1
SCHEMBL21417496 0.74 NT5E (0.56) PNPPOLBHPRT1

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-3512863-B1 2'-SUBSTITUTED-N6-SUBSTITUTED PURINE NUCLEOTIDES FOR RNA VIRUS TREATMENT ATEA PHARMACEUTICALS INC (US) 2021-12-08 — — EP disclosed
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