SCHEMBL11193799

SCHEMBL11193799

Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)O)C[C@]1(O)NC(=O)[C@H](CCCCNC(=O)OCc1ccccc1)NC(=O)OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ DOT1L Q8TEK3 5/20 0.52
▸ AHCY P23526 2/20 0.44
▸ PLA2G2A P14555 1/20 0.42
▸ PRKACA P17612 3/20 0.41
▸ SIRT5 Q9NXA8 1/20 0.39

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
SCHEMBL10887920 0.80 DOT1L (0.62) DOT1LAHCYPLA2G2APRKACA
SCHEMBL16574770 0.71 DOT1L (0.60) DOT1LAHCYPLA2G2APRKACA
SCHEMBL29540124 0.71 DOT1L (0.61) DOT1LAHCYPRKACA
SCHEMBL5943937 0.69 DOT1L (0.52) DOT1LAHCYPRKACA
SCHEMBL10886925 0.69 DOT1L (0.48) DOT1LAHCY
SCHEMBL14905923 0.68 DOT1L (0.60) DOT1LAHCYPLA2G2A
SCHEMBL10885233 0.68 AHCY (0.62) DOT1LAHCYPLA2G2APRKACA
SCHEMBL10887149 0.68 AHCY (0.62) DOT1LAHCYPLA2G2APRKACA
SCHEMBL16578293 0.68 DOT1L (0.68) DOT1LAHCYPRKACA
SCHEMBL5944004 0.67 DOT1L (0.61) DOT1LAHCYPRKACA

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
EP-0071926-A1 New ribofuranuronic acid derivatives, processes for preparation thereof and pharmaceutical compositions thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-02-16 — — EP disclosed
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