SCHEMBL27499321

SCHEMBL27499321

N#Cc1cc(N2CCCCC2c2ccc(N3CCOCC3)cc2)ccc1N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LGMN Q99538 4/20 0.44
MAPT P10636 3/20 0.43
LMNA P02545 2/20 0.43
HTT P42858 2/20 0.43
KDM4E B2RXH2 1/20 0.43
NSD2 O96028 1/20 0.43
TSHR P16473 1/20 0.43
CASP1 P29466 1/20 0.43
CASP7 P55210 1/20 0.43
CASP6 P55212 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TBK1 Q9UHD2 3/20 0.43
PIK3C3 Q8NEB9 4/20 0.41
PIK3CG P48736 2/20 0.38
MAPK1 P28482 2/20 0.37
PRKDC P78527 1/20 0.36
GAA P10253 2/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
S100B P04271 1/20 0.35

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
SCHEMBL27516708 0.83 MAPT (0.50) LGMNMAPTLMNAHTTKDM4E
SCHEMBL2450403 0.80 MAPT (0.63) LGMNMAPTLMNAHTTKDM4E
SCHEMBL27499322 0.74 KDM1A (0.36) MAPTLMNAHTTKDM4ENSD2
SCHEMBL6052510 0.74 KDM4E (0.49) LGMNMAPTLMNAHTTKDM4E
SCHEMBL27500564 0.74 MAPT (0.40) LGMNMAPTLMNAHTTKDM4E
SCHEMBL2979851 0.73 MAPT (0.56) LGMNMAPTLMNAHTTKDM4E
SCHEMBL5461329 0.72 MAPT (0.59) LGMNMAPTLMNAHTTKDM4E
SCHEMBL3184909 0.72 CHUK (0.44) MAPTKDM4ETSHRCASP1CASP7
SCHEMBL81970 0.70 MAPT (0.63) LGMNMAPTLMNAHTTKDM4E
SCHEMBL15938567 0.68 CHUK (0.47) MAPTKDM4ETSHRCASP1CASP7

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1230421-C Amide compound and pharmaceutical use thereof MITSUBISHI CHEM CORP (JP) 2005-12-07 CN disclosed
CN-1346348-A Amide compound and pharmaceutical use thereof YOSHITOMI PHARMACEUTICAL (JP) 2002-04-24 CN disclosed