SCHEMBL14075956

SCHEMBL14075956

CC1(O)[C@H](O)[C@@H](CO)O[C@@H]1n1ncc2c(Cl)ncnc21

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 9/20 0.50
▸ ADORA3 P0DMS8 11/20 0.46
▸ ADORA1 P30542 8/20 0.46
▸ ADORA2B P29275 4/20 0.46
▸ ALOX15 P16050 1/20 0.42
▸ ADK P55263 1/20 0.36
▸ SLC29A1 Q99808 1/20 0.36
▸ ADA P00813 1/20 0.36

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
SCHEMBL4423328 1.00 ADORA2A (0.50) ADORA2AADORA3ADORA1ADORA2BALOX15
SCHEMBL13598822 1.00 ADORA2A (0.50) ADORA2AADORA3ADORA1ADORA2BALOX15
SCHEMBL13598784 1.00 ADORA2A (0.50) ADORA2AADORA3ADORA1ADORA2BALOX15
SCHEMBL16174393 0.86 ADORA2A (0.61) ADORA2AADORA3ADORA1ADORA2BADA
SCHEMBL1737331 0.86 ADORA2A (0.61) ADORA2AADORA3ADORA1ADORA2BADA
SCHEMBL4426285 0.85 ADORA3 (0.50) ADORA2AADORA3ADORA1ADORA2BALOX15
SCHEMBL13598668 0.85 ADORA3 (0.50) ADORA2AADORA3ADORA1ADORA2BALOX15
SCHEMBL13598823 0.85 ADORA3 (0.50) ADORA2AADORA3ADORA1ADORA2BALOX15
SCHEMBL14089315 0.85 ADORA3 (0.50) ADORA2AADORA3ADORA1ADORA2BALOX15
SCHEMBL14089579 0.83 ADORA3 (0.50) ADORA2AADORA3ADORA1ADORA2BALOX15

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-7425547-B2 Nucleoside derivatives for treating hepatitis C virus infection GENELABS TECHNOLOGIES, INC. (US) 2008-09-16 — — US disclosed
US-7425547-B2 Nucleoside derivatives for treating hepatitis C virus infection GENELABS TECHNOLOGIES, INC. (US) 2008-09-16 — — US disclosed
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