SCHEMBL31570706

SCHEMBL31570706

Cc1noc(-c2ccccc2)c1CSC[C@H]1O[C@@H](n2ccc3c(N)nc(F)nc32)[C@@H]2OC(C)(C)O[C@@H]21

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ AMD1 P17707 2/20 0.32
▸ PI4KA P42356 1/20 0.31
▸ PI4K2B Q8TCG2 1/20 0.31
▸ PI4K2A Q9BTU6 1/20 0.31
▸ PI4KB Q9UBF8 1/20 0.31
▸ PRMT5 O14744 3/20 0.31
▸ WDR77 Q9BQA1 3/20 0.31
▸ RXFP1 Q9HBX9 1/20 0.30
▸ NT5E P21589 1/20 0.30

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
SCHEMBL31570695 0.93 AMD1 (0.33) AMD1PI4KAPI4K2BPI4K2API4KB
SCHEMBL31526112 0.91 NT5E (0.37) AMD1PI4KAPI4K2BPI4K2API4KB
SCHEMBL31526180 0.86 DNMT1 (0.42) PRMT5WDR77NT5E
SCHEMBL31526328 0.80 PI4KA (0.39) AMD1PI4KAPI4K2BPI4K2API4KB
SCHEMBL31526226 0.79 DNMT1 (0.43) PRMT5WDR77NT5E
SCHEMBL31526362 0.77 NT5E (0.43) PRMT5WDR77NT5E
SCHEMBL31526378 0.74 DNMT1 (0.57) PRMT5WDR77
SCHEMBL31526133 0.70 DNMT1 (0.55) PRMT5WDR77
SCHEMBL31526113 0.68 PI4KA (0.39) AMD1PI4KAPI4K2BPI4K2API4KB
SCHEMBL18571691 0.67 PI4KA (0.53) PI4KAPI4K2BPI4K2API4KBPRMT5

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-4553080-A1 NUCLEOSIDE DERIVATIVES AS ANTIVIRAL AGENTS AGAINST CORONAVIRUSES Ustav Organicke Chemie a Biochemie AV CR, v.v.i. (CZ) 2025-05-14 — — EP disclosed
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