SCHEMBL23010195

SCHEMBL23010195

CCOc1nc(N)nc2c1ncn2[C@@H]1O[C@](F)(COP(=O)(O)OC(C)C)C[C@@H]1C

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NT5E P21589 4/20 0.36
▸ SLC29A1 Q99808 1/20 0.34
▸ P2RY1 P47900 5/20 0.34
▸ P2RY2 P41231 1/20 0.33
▸ CA5A P35218 1/20 0.33
▸ FUT5 Q11128 1/20 0.33
▸ ENPP1 P22413 2/20 0.33

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
SCHEMBL20611183 0.85 STING1 (0.36) NT5ESLC29A1
SCHEMBL23010194 0.84 NT5E (0.33) NT5ESLC29A1P2RY1P2RY2
SCHEMBL22474927 0.84 ADORA3 (0.39) SLC29A1
SCHEMBL19187036 0.81 NT5E (0.41) NT5ESLC29A1P2RY1P2RY2FUT5
SCHEMBL23348445 0.78 CYP3A4 (0.36) —
SCHEMBL20754387 0.77 SLC29A1 (0.33) SLC29A1
SCHEMBL15678090 0.76 P2RY1 (0.43) P2RY1P2RY2ENPP1
SCHEMBL19778461 0.75 ADORA3 (0.41) NT5EP2RY1
SCHEMBL19186747 0.74 NT5E (0.41) NT5EP2RY1P2RY2FUT5ENPP1
SCHEMBL19778378 0.74 FUT5 (0.53) NT5EP2RY2FUT5

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-2935303-B1 4'-FLUORO-NUCLEOSIDES, 4'-FLUORO-NUCLEOTIDES AND ANALOGS THEREOF FOR THE TREATMENT OF HCV JANSSEN BIOPHARMA INC (US) 2021-02-17 — — EP disclosed
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