SCHEMBL31526112

SCHEMBL31526112

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

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NT5E P21589 2/20 0.37
▸ 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

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
SCHEMBL31570706 0.91 AMD1 (0.32) NT5EAMD1PI4KAPI4K2BPI4K2A
SCHEMBL31526362 0.86 NT5E (0.43) NT5EPRMT5WDR77
SCHEMBL31526226 0.79 DNMT1 (0.43) NT5EPRMT5WDR77
SCHEMBL31526328 0.77 PI4KA (0.39) AMD1PI4KAPI4K2BPI4K2API4KB
SCHEMBL31526180 0.77 DNMT1 (0.42) NT5EPRMT5WDR77
SCHEMBL18571690 0.75 PI4KA (0.53) NT5EPI4KAPI4K2BPI4K2API4KB
SCHEMBL31526212 0.75 NT5E (0.44) NT5EAMD1PI4KAPI4K2BPI4K2A
SCHEMBL31526378 0.74 DNMT1 (0.57) PRMT5WDR77
SCHEMBL31570716 0.73 NT5E (0.42) NT5EPI4KAPI4K2BPI4K2API4KB

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
WO-2025098545-A1 NUCLEOSIDE DERIVATIVES AS ANTIVIRAL AGENTS AGAINST CORONAVIRUSES USTAV ORGANICKE CHEMIE A BIOCHEMIE AV CR, V. V. I. (CZ) 2025-05-15 — — WO disclosed
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