SCHEMBL31526113

SCHEMBL31526113

CC(=O)SC[C@H]1O[C@@H](n2ccc3c(N)nc(C)nc32)[C@@H]2OC(C)(C)O[C@@H]21

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PI4KA P42356 1/20 0.39
▸ PI4K2B Q8TCG2 1/20 0.39
▸ PI4K2A Q9BTU6 1/20 0.39
▸ PI4KB Q9UBF8 1/20 0.39
▸ PRMT5 O14744 8/20 0.38
▸ WDR77 Q9BQA1 7/20 0.38
▸ AMD1 P17707 2/20 0.36
▸ RXFP1 Q9HBX9 1/20 0.35
▸ DNMT1 P26358 2/20 0.35
▸ DNMT3B Q9UBC3 2/20 0.35
▸ NT5E P21589 2/20 0.35
▸ P2RX1 P51575 1/20 0.34
▸ P2RX3 P56373 1/20 0.34
▸ P2RX4 Q99571 1/20 0.34
▸ ADK P55263 1/20 0.34

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
SCHEMBL31526212 0.90 NT5E (0.44) PI4KAPI4K2BPI4K2API4KBPRMT5
SCHEMBL18571691 0.85 PI4KA (0.53) PI4KAPI4K2BPI4K2API4KBPRMT5
SCHEMBL18009750 0.76 PI4KA (0.48) PI4KAPI4K2BPI4K2API4KBPRMT5
SCHEMBL19343880 0.76 PRMT5 (0.58) PI4KAPI4K2BPI4K2API4KBPRMT5
SCHEMBL31526335 0.75 ALDH1A1 (0.34) PRMT5WDR77NT5EADK
SCHEMBL31570695 0.75 AMD1 (0.33) PI4KAPI4K2BPI4K2API4KBPRMT5
SCHEMBL18026299 0.75 PI4KA (0.38) PI4KAPI4K2BPI4K2API4KBPRMT5
SCHEMBL18571690 0.75 PI4KA (0.53) PI4KAPI4K2BPI4K2API4KBPRMT5
SCHEMBL19343891 0.74 PRMT5 (0.47) PI4KAPI4K2BPI4K2API4KBPRMT5
SCHEMBL14174543 0.74 PI4KA (0.73) PI4KAPI4K2BPI4K2API4KBAMD1

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 2 patents. 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
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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