SCHEMBL8257983

SCHEMBL8257983

NC(=O)C1CCCc2[nH]c3ccc(Cl)cc3c21

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SIRT1 Q96EB6 15/20 0.66
SIRT2 Q8IXJ6 5/20 0.66
SIRT3 Q9NTG7 2/20 0.66
ALOX15 P16050 3/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
TSHR P16473 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.50
MAPT P10636 2/20 0.50
MAPK1 P28482 1/20 0.50
LMNA P02545 2/20 0.48
TP53 P04637 1/20 0.48
RECQL P46063 1/20 0.47

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
SCHEMBL3258128 0.81 SIRT1 (0.63) SIRT1SIRT2SIRT3SMN1; SMN2RECQL
SCHEMBL1275557 0.80 SIRT1 (1.00) SIRT1SIRT2SIRT3ALOX15MEN1
SCHEMBL1870769 0.80 SIRT1 (1.00) SIRT1SIRT2SIRT3ALOX15MEN1
SCHEMBL1874310 0.80 SIRT1 (1.00) SIRT1SIRT2SIRT3ALOX15MEN1
Sulfuric Acid SCHEMBL8592514 0.77 SIRT1 (0.57) SIRT1SIRT2SIRT3SMN1; SMN2RECQL
SCHEMBL8257650 0.76 SIRT1 (1.00) SIRT1SIRT2SIRT3ALOX15MEN1
SCHEMBL1873844 0.76 SIRT1 (1.00) SIRT1SIRT2SIRT3ALOX15MEN1
SCHEMBL8251110 0.76 SIRT1 (1.00) SIRT1SIRT2SIRT3ALOX15MEN1
SCHEMBL31328299 0.74 SIRT1 (0.65) SIRT1SIRT2SIRT3ALOX15MEN1
SCHEMBL30849292 0.74 ADRA2A (0.49) SIRT1SIRT2ALOX15KMT2ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1677794-B1 METHODS OF TREATING DISORDER ELIXIR PHARMACEUTICALS INC (US) 2014-12-03 EP disclosed
WO-2010054382-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR TREATING MALARIA OR LEISHMANIASIS ELIXIR PHARMACEUTICALS, INC. (US) 2010-05-14 WO disclosed
WO-2008082646-A2 HISTONE DEACETYLASE INHIBITORS, COMBINATION THERAPIES AND METHODS OF USE THE JOHNS HOPKINS UNIVERSITY (US) 2008-07-10 WO disclosed
WO-2006099245-A9 SIRT INHIBITORS THAT BIND TO NAD ELIXIR PHARMACEUTICALS INC (US) 2006-11-09 WO disclosed
WO-2006099245-A1 SIRT INHIBITORS THAT BIND TO NAD ELIXIR PHARMACEUTICALS, INC. (US) 2006-09-21 WO disclosed
WO-2006031894-A2 METHODS OF TREATING A DISORDER ELIXIR PHARMACEUTICALS, INC. (US) 2006-03-23 WO disclosed
WO-2005072408-A2 TREATING A VIRAL DISORDER ELIXIR PHARMACEUTICALS, INC (US) 2005-08-11 WO disclosed
WO-2005026112-A2 METHODS OF TREATING A DISORDER ELIXIR PHARMACEUTICALS, INC. (US) 2005-03-24 WO disclosed