SCHEMBL302171

SCHEMBL302171

Cn1cnc(C(=O)Nc2cccc(N(Cc3ccccc3)S(=O)(=O)c3ccccc3)c2)c1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 13/20 0.52
LMNA P02545 7/20 0.52
HTT P42858 2/20 0.49
GAA P10253 1/20 0.49
CACNA1H O95180 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 3/20 0.46
KMT2A Q03164 1/20 0.46
KDM4E B2RXH2 1/20 0.45

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 0.82 LMNA (0.49) MAPTLMNAHTTGAASMN1; SMN2
SCHEMBL302170 0.80 LMNA (0.53) MAPTLMNAHTTGAASMN1; SMN2
SCHEMBL301695 0.79 GAA (0.76) MAPTLMNAHTTGAACACNA1H
SCHEMBL3278531 0.76 HTT (0.57) MAPTLMNAHTTGAACACNA1H
SCHEMBL3377228 0.76 MAPT (0.74) MAPTLMNAHTTGAASMN1; SMN2
SCHEMBL3235755 0.75 HTT (0.57) MAPTLMNAHTTGAACACNA1H
SCHEMBL3279971 0.75 MAPT (0.61) MAPTLMNAHTTGAACACNA1H
SCHEMBL1964073 0.74 GAA (0.55) MAPTLMNAHTTGAACACNA1H
SCHEMBL14401108 0.74 POLB (0.53) MAPTSMN1; SMN2ALDH1A1KMT2AKDM4E
SCHEMBL3377793 0.73 MAPT (0.64) MAPTLMNAHTTGAASMN1; SMN2

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
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
EP-2334637-A1 NOVEL POTASSIUM CHANNEL BLOCKERS Xention Limited (GB) 2011-06-22 EP disclosed