SCHEMBL11760829

SCHEMBL11760829

CC(C)[Si](OC[C@H]1OC(n2cnc3c(N)ncnc32)[C@@H](O)[C@@H]1O)(C(C)C)C(C)C

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA1 P30542 5/20 0.67
▸ SMN1; SMN2 Q16637 3/20 0.67
▸ DOT1L Q8TEK3 2/20 0.67
▸ ADORA3 P0DMS8 2/20 0.67
▸ ADORA2A P29274 2/20 0.67
▸ ADORA2B P29275 2/20 0.67
▸ DPP4 P27487 1/20 0.67
▸ MEN1 O00255 1/20 0.67
▸ SLC28A1 O00337 1/20 0.67
▸ MAP3K7 O43318 1/20 0.67
▸ SLC28A2 O43868 1/20 0.67
▸ GAPDH P04406 1/20 0.67
▸ MAPK1 P28482 1/20 0.67
▸ STAT6 P42226 1/20 0.67
▸ PI4KA P42356 1/20 0.67
▸ KMT2A Q03164 1/20 0.67
▸ PI4K2B Q8TCG2 1/20 0.67
▸ SLC29A1 Q99808 1/20 0.67
▸ PI4K2A Q9BTU6 1/20 0.67
▸ SLC28A3 Q9HAS3 1/20 0.67

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
SCHEMBL5273183 1.00 ADORA1 (0.67) ADORA1SMN1; SMN2DOT1LADORA3ADORA2A
SCHEMBL1800135 1.00 ADORA1 (0.67) ADORA1SMN1; SMN2DOT1LADORA3ADORA2A
SCHEMBL11889844 1.00 ADORA1 (0.67) ADORA1SMN1; SMN2DOT1LADORA3ADORA2A
SCHEMBL11680804 0.92 ADORA1 (0.67) ADORA1SMN1; SMN2DOT1LADORA3ADORA2A
SCHEMBL11680796 0.92 ADORA1 (0.67) ADORA1SMN1; SMN2DOT1LADORA3ADORA2A
SCHEMBL11679876 0.89 ADORA1 (0.73) ADORA1SMN1; SMN2DOT1LADORA3ADORA2A
SCHEMBL7435435 0.87 AHCY (0.71) ADORA1SMN1; SMN2DOT1LADORA3ADORA2A
SCHEMBL5581331 0.86 ADORA1 (0.69) ADORA1SMN1; SMN2DOT1LADORA3ADORA2A
SCHEMBL41361 0.86 ADORA1 (0.74) ADORA1SMN1; SMN2DOT1LADORA3ADORA2A
SCHEMBL15788449 0.86 ADORA1 (0.74) ADORA1SMN1; SMN2DOT1LADORA3ADORA2A

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
US-4055717-A 9-(3-O-Acyl-β-D-arabinofuranosyl)adenine compounds, 9-(2,3-di-O-acyl-β-D-arabinofuranosyl)-adenine compounds, and method for their production PARKE, DAVIS & COMPANY (US) 1977-10-25 — — US disclosed
US-4048432-A 9-(3,5-Di-O-acyl-β-D-arabinofuranosyl)adenine compounds and method for their production PARKE, DAVIS & COMPANY (US) 1977-09-13 — — US disclosed
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