SCHEMBL7270643

SCHEMBL7270643

Cc1cn([C@H]2CC(O)[C@@H](COC(=O)OCc3cccc4cccc([N+](=O)[O-])c34)O2)c(=O)[nH]c1=O

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.49
POLB P06746 1/20 0.47
TYMS P04818 1/20 0.45

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
SCHEMBL6886185 1.00 BCHE (0.49) BCHEPOLBTYMS
SCHEMBL7644585 0.92 POLB (0.50) BCHEPOLBTYMS
SCHEMBL8723691 0.92 POLB (0.50) BCHEPOLBTYMS
SCHEMBL6886191 0.86 DNPH1 (0.39) BCHE
SCHEMBL7644907 0.86 TK1 (0.51) BCHEPOLBTYMS
SCHEMBL8719115 0.86 TK1 (0.51) BCHEPOLBTYMS
SCHEMBL13041157 0.86 BCHE (0.48) BCHEPOLBTYMS
SCHEMBL7648168 0.85 TYMS (0.52) BCHEPOLBTYMS
SCHEMBL8718687 0.85 BCHE (0.50) BCHEPOLBTYMS
SCHEMBL7644420 0.85 BCHE (0.50) BCHEPOLBTYMS

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-6552182-B2 Gel or viscous liquid of polymer compounds and water, water/ alcohol mixtures and polar aprotic solvents is coated on the nucleoside and irradiated NIGU CHEMIE GMBH (DE) 2003-04-22 US disclosed
US-20020053508-A1 Method for photolytically deprotecting immobilized nucleoside derivatives, especially in the production of DNA chips NIGU CHEMIE GMBH 2002-05-09 US disclosed