SCHEMBL6052308

SCHEMBL6052308

NC(=O)c1cc(N)ccc1N1CCC(N2CCOCC2)CC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GFER P55789 2/20 0.60
MAPT P10636 2/20 0.60
KDM4E B2RXH2 1/20 0.60
MEN1 O00255 1/20 0.60
THRB P10828 1/20 0.60
ALOX15 P16050 1/20 0.60
YWHAG P61981 1/20 0.60
KMT2A Q03164 1/20 0.60
HSD17B10 Q99714 1/20 0.60
HTT P42858 1/20 0.59
GAA P10253 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.46
ALDH1A1 P00352 1/20 0.44
AOC3 Q16853 2/20 0.43
JAK2 O60674 1/20 0.43
L3MBTL3 Q96JM7 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ACVR1 Q04771 3/20 0.43
PARP1 P09874 1/20 0.42
FLT3 P36888 3/20 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
SCHEMBL79339 0.87 KDM4E (0.74) GFERMAPTKDM4EMEN1THRB
SCHEMBL6052293 0.80 MAPT (0.72) MAPTKDM4EMEN1KMT2AHTT
SCHEMBL17450416 0.79 ALDH1A1 (0.54) GFERMAPTKDM4EALOX15HTT
SCHEMBL6052282 0.79 MAPT (0.55) GFERMAPTKDM4EMEN1THRB
SCHEMBL6052155 0.79 MAPT (0.50) MAPTKDM4EHTTGAASMN1; SMN2
SCHEMBL28742790 0.78 GFER (0.45) GFERMAPTKDM4EMEN1THRB
SCHEMBL2448297 0.77 MAPT (0.50) MAPTKDM4EHSD17B10HTTGAA
SCHEMBL17774819 0.76 KDM4E (1.00) GFERMAPTKDM4EMEN1THRB
SCHEMBL6052248 0.76 MAPT (0.47) MAPTKDM4ETHRBHTTGAA
SCHEMBL17631428 0.76 GAA (0.47) MAPTKDM4EHTTGAASMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7015218-B1 Amide compounds and medicinal use thereof MITSUBISHI PHARMA CORPORATION (JP) 2006-03-21 US disclosed
EP-1176140-B1 AMIDE COMPOUNDS AND MEDICINAL USE THEREOF MITSUBISHI PHARMA CORP (JP) 2004-12-29 EP disclosed
EP-1176140-A1 AMIDE COMPOUNDS AND MEDICINAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2002-01-30 EP disclosed