SCHEMBL3978681

SCHEMBL3978681

Nc1ncnc2c1ncn2[C@@H]1O[C@](F)(COS(N)(=O)=O)C(O)C1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 1/20 0.54
▸ WDR77 Q9BQA1 1/20 0.54
▸ AHCY P23526 7/20 0.52
▸ HSP90B1 P14625 3/20 0.51
▸ ADORA2A P29274 2/20 0.51
▸ ADORA2B P29275 2/20 0.51
▸ HIF1A Q16665 1/20 0.51
▸ TMEM97 Q5BJF2 1/20 0.51
▸ SIGMAR1 Q99720 1/20 0.51
▸ HSP90AA1 P07900 1/20 0.49
▸ DPP4 P27487 1/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ SLC28A1 O00337 1/20 0.49
▸ MAP3K7 O43318 1/20 0.49
▸ SLC28A2 O43868 1/20 0.49
▸ GAPDH P04406 1/20 0.49
▸ ADORA3 P0DMS8 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ ADORA1 P30542 1/20 0.49
▸ STAT6 P42226 1/20 0.49

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
SCHEMBL3978671 1.00 PRMT5 (0.54) PRMT5WDR77AHCYHSP90B1ADORA2A
SCHEMBL29712359 1.00 PRMT5 (0.54) PRMT5WDR77AHCYHSP90B1ADORA2A
SCHEMBL3980534 1.00 PRMT5 (0.54) PRMT5WDR77AHCYHSP90B1ADORA2A
SCHEMBL13844404 0.84 PRMT5 (0.61) PRMT5WDR77AHCYADORA2AADORA2B
Nonactin SCHEMBL8750347 0.82 PRMT5 (0.44) PRMT5WDR77AHCYHSP90B1ADORA2A
SCHEMBL15828310 0.81 P2RX1 (0.63) ADORA1SMN1; SMN2
SCHEMBL15828228 0.81 P2RX1 (0.63) ADORA1SMN1; SMN2
SCHEMBL31725331 0.78 AHCY (0.53) PRMT5WDR77AHCYHSP90B1ADORA2A
SCHEMBL21015672 0.78 AHCY (0.50) AHCYADORA2BSLC28A1SLC28A2
SCHEMBL25390968 0.78 ADORA3 (0.57) PRMT5WDR77AHCYADORA2AADORA2B

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-2009058800-A2 SYNTHESIS OF NUCLEOSIDES PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2009-05-07 — — WO disclosed
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