SCHEMBL25711923

SCHEMBL25711923

CC(=O)OC1CC(CO)OC1n1cnc2c(=O)[nH]c(N)nc21

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HINT1 P49773 3/20 0.50
▸ HPGD P15428 1/20 0.50
▸ GSK3A P49840 2/20 0.47
▸ RPS6KA3 P51812 2/20 0.47
▸ MAPK14 Q16539 2/20 0.47
▸ NT5E P21589 1/20 0.46
▸ FUT5 Q11128 1/20 0.46
▸ TLR7 Q9NYK1 2/20 0.46
▸ HPRT1 P00492 2/20 0.45
▸ STING1 Q86WV6 2/20 0.45
▸ PDE3B Q13370 1/20 0.45
▸ PDE3A Q14432 1/20 0.45
▸ ADORA3 P0DMS8 1/20 0.45

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
SCHEMBL18759054 0.92 HINT1 (0.54) HINT1HPGDGSK3ARPS6KA3MAPK14
SCHEMBL7257443 0.92 HINT1 (0.54) HINT1HPGDGSK3ARPS6KA3MAPK14
SCHEMBL30612754 0.89 HPGD (0.54) HINT1HPGDGSK3ARPS6KA3MAPK14
SCHEMBL31583575 0.87 FUT5 (0.53) HINT1HPGDNT5EFUT5HPRT1
SCHEMBL20833471 0.86 HPGD (0.51) HINT1HPGDGSK3ARPS6KA3MAPK14
SCHEMBL7253951 0.85 TYMP (0.49) HINT1HPGDGSK3ARPS6KA3MAPK14
SCHEMBL7253950 0.85 TYMP (0.49) HINT1HPGDGSK3ARPS6KA3MAPK14
SCHEMBL18521008 0.84 FUT5 (0.55) HINT1HPGDGSK3ARPS6KA3MAPK14
SCHEMBL19242512 0.84 HPGD (0.52) HINT1HPGDNT5EFUT5TLR7
SCHEMBL19882058 0.84 HPGD (0.52) HINT1HPGDNT5EFUT5TLR7

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-3131914-B1 3'-SUBSTITUTED METHYL OR ALKYNYL NUCLEOSIDES FOR THE TREATMENT OF HCV IDENIX PHARMACEUTICALS LLC (US) 2023-05-10 — — EP disclosed
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