SCHEMBL303294

SCHEMBL303294

Cn1ccc(S(=O)(=O)N(Cc2ccc(Cl)cc2)c2cccc(C(=O)NC3CC3)c2)n1.Cn1ccc(S(=O)(=O)N(Cc2ccc(Cl)cc2)c2cccc(C(=O)NC3CCC3)c2)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
HSD17B10 Q99714 2/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
KDM4E B2RXH2 1/20 0.43
GFER P55789 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PSEN1 P49768 2/20 0.43
PSEN2 P49810 2/20 0.43
APH1B Q8WW43 2/20 0.43
NCSTN Q92542 2/20 0.43
APH1A Q96BI3 2/20 0.43
PSENEN Q9NZ42 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MITF O75030 1/20 0.41
RAD52 P43351 1/20 0.41
CTSD P07339 2/20 0.41
BACE1 P56817 2/20 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
SCHEMBL3377043 0.99 MEN1 (0.47) MEN1KMT2AHSD17B10NPC1RAB9A
SCHEMBL302949 0.97 MEN1 (0.49) MEN1KMT2AHSD17B10NPC1RAB9A
SCHEMBL2214837 0.97 MEN1 (0.44) MEN1KMT2AHSD17B10NPC1RAB9A
SCHEMBL2214713 0.96 MEN1 (0.45) MEN1KMT2AHSD17B10NPC1RAB9A
SCHEMBL2211916 0.86 MEN1 (0.42) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL2215417 0.86 KMT2A (0.37) MEN1KMT2AHSD17B10NPC1RAB9A
SCHEMBL303432 0.85 LMNA (0.42) MEN1KMT2AKDM4EPSEN1PSEN2
SCHEMBL303633 0.85 MEN1 (0.47) MEN1KMT2AHSD17B10NPC1RAB9A
SCHEMBL2214180 0.85 MEN1 (0.54) MEN1KMT2AALDH1A1
SCHEMBL304312 0.85 KMT2A (0.40) MEN1KMT2ASMN1; SMN2ALDH1A1GAA

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