SCHEMBL302170

SCHEMBL302170

Cn1cnc(C(=O)O)c1.NC(=O)c1cccc(N(Cc2ccccc2)S(=O)(=O)c2ccccc2)c1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.53
ALDH1A1 P00352 2/20 0.53
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48
MAPT P10636 5/20 0.44
TP53 P04637 1/20 0.43
HPGD P15428 2/20 0.43
KDM4E B2RXH2 1/20 0.43
HSD17B10 Q99714 1/20 0.43
NR1I2 O75469 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PTGES O14684 1/20 0.42
ALOX5 P09917 1/20 0.42
FNTA P49354 1/20 0.42
FNTB P49356 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ESR1 P03372 1/20 0.42
GAA P10253 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL302172 0.89 LMNA (0.49) LMNAALDH1A1KMT2AMEN1MAPT
SCHEMBL1967123 0.84 LMNA (0.68) LMNAALDH1A1KMT2AMEN1MAPT
SCHEMBL302171 0.80 MAPT (0.52) LMNAALDH1A1KMT2AMAPTKDM4E
SCHEMBL2212915 0.79 MEN1 (0.58) LMNAALDH1A1KMT2AMEN1MAPT
SCHEMBL2189346 0.77 LMNA (0.85) LMNAALDH1A1KMT2AMEN1MAPT
SCHEMBL3377793 0.75 MAPT (0.64) LMNAALDH1A1KMT2AMEN1MAPT
SCHEMBL302889 0.73 LMNA (0.54) LMNAALDH1A1KMT2AMEN1MAPT
SCHEMBL325167 0.73 MEN1 (0.52) LMNAALDH1A1KMT2AMEN1MAPT
SCHEMBL3378728 0.73 MAPT (0.70) LMNAALDH1A1KMT2AMAPTKDM4E
SCHEMBL2211492 0.72 MEN1 (0.53) LMNAALDH1A1KMT2AMEN1FNTA

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-2012500835-A 2012-01-12 JP claimed
EP-2334637-A1 NOVEL POTASSIUM CHANNEL BLOCKERS Xention Limited (GB) 2011-06-22 EP claimed
WO-2010023446-A1 NOVEL POTASSIUM CHANNEL BLOCKERS XENTION LIMITED (GB) 2010-03-04 WO claimed