SCHEMBL3229166

SCHEMBL3229166

C#CC[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1ccc2c(N)ncnc21

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ADK P55263 2/20 0.50
▸ ADORA2A P29274 1/20 0.47
▸ PRMT5 O14744 15/20 0.47
▸ WDR77 Q9BQA1 12/20 0.47
▸ METTL3 Q86U44 1/20 0.43
▸ DOT1L Q8TEK3 1/20 0.41

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
SCHEMBL731889 0.89 ADK (0.56) ADKADORA2APRMT5WDR77METTL3
SCHEMBL12154683 0.89 ADK (0.56) ADKADORA2APRMT5WDR77METTL3
SCHEMBL6841559 0.89 ADK (0.56) ADKADORA2APRMT5WDR77METTL3
SCHEMBL12150845 0.89 ADK (0.56) ADKADORA2APRMT5WDR77METTL3
SCHEMBL3229893 0.87 PRMT5 (0.50) ADKADORA2APRMT5WDR77METTL3
SCHEMBL17109566 0.87 PRMT5 (0.50) ADKADORA2APRMT5WDR77METTL3
SCHEMBL21006387 0.87 PRMT5 (0.50) ADKADORA2APRMT5WDR77METTL3
SCHEMBL3234238 0.87 PRMT5 (0.50) ADKADORA2APRMT5WDR77METTL3
SCHEMBL3232370 0.87 ADORA2A (0.39) ADKADORA2APRMT5WDR77METTL3
SCHEMBL19535607 0.87 PRMT5 (0.50) ADKADORA2APRMT5WDR77METTL3

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-2010015637-A1 NEW ANTIVIRAL MODIFIED NUCLEOSIDES NOVARTIS AG (CH) 2010-02-11 — — WO disclosed
WO-2010015637-A1 NEW ANTIVIRAL MODIFIED NUCLEOSIDES NOVARTIS AG (CH) 2010-02-11 — — WO disclosed
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