SCHEMBL302172

SCHEMBL302172

Cn1cnc(C(=O)O)c1.Nc1cccc(N(Cc2ccccc2)S(=O)(=O)c2ccccc2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.49
ALDH1A1 P00352 3/20 0.49
MEN1 O00255 5/20 0.45
KMT2A Q03164 5/20 0.45
NR1I2 O75469 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
ESR1 P03372 1/20 0.43
GAA P10253 1/20 0.43
HTT P42858 1/20 0.43
MCL1 Q07820 1/20 0.42
ACHE P22303 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HTR1A P08908 1/20 0.42
HTR2A P28223 1/20 0.42
HTR2C P28335 1/20 0.42
HTR7 P34969 1/20 0.42
DRD3 P35462 1/20 0.42
HTR6 P50406 1/20 0.42
KDM4E B2RXH2 1/20 0.42
HPGD P15428 1/20 0.42

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
SCHEMBL302170 0.89 LMNA (0.53) LMNAALDH1A1MEN1KMT2ANR1I2
SCHEMBL302171 0.82 MAPT (0.52) LMNAALDH1A1KMT2AGAAHTT
SCHEMBL1964511 0.81 MEN1 (0.62) LMNAALDH1A1MEN1KMT2ANR1I2
SCHEMBL2212915 0.75 MEN1 (0.58) LMNAALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL302890 0.72 HTT (0.51) LMNAALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL2189346 0.72 LMNA (0.85) LMNAALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL3274287 0.70 KMT2A (0.60) LMNAALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL6562153 0.70 ALDH1A1 (0.47) LMNAALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL1937572 0.70 LMNA (0.55) LMNAALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL1967123 0.70 LMNA (0.68) LMNAALDH1A1MEN1KMT2ANR1I2

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