SCHEMBL2902501

SCHEMBL2902501

CCCCCCCCCC1(CO)CO1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 1/20 0.51
GAA P10253 1/20 0.41
LMNA P02545 2/20 0.39
ALDH1A1 P00352 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TSHR P16473 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
SCHEMBL2110069 1.00 SIRT2 (0.51) SIRT2GAALMNAALDH1A1HSD17B10
SCHEMBL9587057 1.00 SIRT2 (0.51) SIRT2GAALMNAALDH1A1HSD17B10
SCHEMBL2110034 1.00 SIRT2 (0.51) SIRT2GAALMNAALDH1A1HSD17B10
SCHEMBL2111698 1.00 SIRT2 (0.51) SIRT2GAALMNAALDH1A1HSD17B10
SCHEMBL2109882 1.00 SIRT2 (0.51) SIRT2GAALMNAALDH1A1HSD17B10
SCHEMBL2110751 1.00 SIRT2 (0.51) SIRT2GAALMNAALDH1A1HSD17B10
SCHEMBL2111446 1.00 SIRT2 (0.51) SIRT2GAALMNAALDH1A1HSD17B10
SCHEMBL2902851 1.00 SIRT2 (0.51) SIRT2GAALMNAALDH1A1HSD17B10
SCHEMBL10996586 1.00 SIRT2 (0.51) SIRT2GAALMNAALDH1A1HSD17B10
SCHEMBL8766498 1.00 SIRT2 (0.51) SIRT2GAALMNAALDH1A1HSD17B10

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2725902-A2 ANTI-VIRAL COMBINATION THERAPY THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2014-05-07 EP disclosed
WO-2012139028-A2 ANTI-VIRAL COMBINATION THERAPY THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2012-10-11 WO disclosed
EP-2166843-A2 TREATMENT OF VIRAL INFECTIONS BY MODULATION OF HOST CELL METABOLIC PATHWAYS THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2010-03-31 EP disclosed
WO-2009023059-A2 TREATMENT OF VIRAL INFECTIONS BY MODULATION OF HOST CELL METABOLIC PATHWAYS THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2009-02-19 WO disclosed