SCHEMBL303675

SCHEMBL303675

N#Cc1cccc(S(=O)(=O)N(Cc2ccc(Cl)cc2)c2ccc(F)c(C(=O)NCCCCO)c2)c1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 4/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
RORC P51449 1/20 0.40
KCNA5 P22460 2/20 0.40
NR1H2 P55055 1/20 0.40
CNR1 P21554 3/20 0.40
CNR2 P34972 3/20 0.40
KAT6A Q92794 1/20 0.40
KCNH2 Q12809 1/20 0.39
NR3C1 P04150 1/20 0.39
PGR P06401 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL302783 0.94 SIRT2 (0.45) SIRT2MEN1KMT2ARORCKCNA5
SCHEMBL3380912 0.89 SIRT2 (0.45) SIRT2MEN1KMT2ARORCKCNA5
SCHEMBL303336 0.85 NR1H2 (0.45) SIRT2MEN1KMT2ARORCKCNA5
SCHEMBL3376406 0.85 SIRT2 (0.44) SIRT2MEN1KMT2ARORCKCNA5
SCHEMBL3377129 0.84 MEN1 (0.55) SIRT2MEN1KMT2ARORCKCNA5
SCHEMBL303335 0.84 NR1H2 (0.45) SIRT2MEN1KMT2ARORCKCNA5
SCHEMBL2186792 0.84 SIRT2 (0.45) SIRT2MEN1KMT2ARORCKCNA5
SCHEMBL303674 0.83 SIRT2 (0.44) SIRT2MEN1KMT2ARORCKCNA5
SCHEMBL3379276 0.79 NR1H2 (0.45) SIRT2MEN1KMT2ARORCKCNA5
SCHEMBL3377427 0.78 KCNA5 (0.45) SIRT2MEN1KMT2ARORCKCNA5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2012500836-A 2012-01-12 JP claimed
EP-2342177-A1 NOVEL POTASSIUM CHANNEL BLOCKERS Xention Limited (GB) 2011-07-13 EP claimed
WO-2010023448-A1 NOVEL POTASSIUM CHANNEL BLOCKERS XENTION LIMITED (GB) 2010-03-04 WO claimed