SCHEMBL31526249

SCHEMBL31526249

CN(C)/C=N\c1nc(C#N)nc2c1c(I)cn2[C@@H]1O[C@H](CO)[C@H]2OC(C)(C)O[C@H]21

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PI4KA P42356 1/20 0.38
▸ PI4K2B Q8TCG2 1/20 0.38
▸ PI4K2A Q9BTU6 1/20 0.38
▸ PI4KB Q9UBF8 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ ADORA3 P0DMS8 1/20 0.33
▸ ADORA1 P30542 1/20 0.33
▸ ADK P55263 2/20 0.33
▸ SLC29A1 Q99808 1/20 0.32

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
SCHEMBL31526187 0.89 — —
SCHEMBL31526227 0.88 — —
SCHEMBL31526298 0.80 — —
SCHEMBL18571692 0.71 PI4KA (0.41) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL23922248 0.70 PI4KA (0.66) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL11685537 0.70 PI4KA (0.66) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL29703062 0.70 PI4KA (0.66) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL22402618 0.70 PI4KA (0.66) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL22393148 0.70 PI4KA (0.66) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL26361515 0.70 PI4KA (0.66) PI4KAPI4K2BPI4K2API4KBALDH1A1

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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