SCHEMBL4724754

SCHEMBL4724754

Cc1ccc(C(=O)NCCC2CCCC2)cc1C(N)=O

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 8/20 0.64
KIT P10721 4/20 0.64
LCK P06239 1/20 0.64
SRC P12931 1/20 0.64
LDLR P01130 1/20 0.60
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
ITGB3 P05106 1/20 0.43
ITGA2B P08514 1/20 0.43
SMYD3 Q9H7B4 1/20 0.42
HDAC3 O15379 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC2 Q92769 1/20 0.42
MAPK11 Q15759 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
SCHEMBL2949693 0.89 MAPK14 (0.62) MAPK14KITLCKSRCLDLR
SCHEMBL2943393 0.86 MAPK14 (0.60) MAPK14KITLCKSRCLDLR
SCHEMBL10321528 0.86 KIT (0.64) MAPK14KITMAPK11
SCHEMBL13234997 0.85 LDLR (0.67) MAPK14KITLCKSRCLDLR
SCHEMBL2951658 0.82 LDLR (0.66) MAPK14KITLCKSRCLDLR
SCHEMBL2943844 0.81 KIT (0.82) MAPK14KITLCKSRCLDLR
SCHEMBL2951060 0.79 KIT (0.79) MAPK14KITLCKSRCLDLR
SCHEMBL2952365 0.79 KIT (1.00) MAPK14KITLCKSRCLDLR
SCHEMBL31004385 0.79 KIT (1.00) MAPK14KITLCKSRCLDLR
SCHEMBL2941807 0.78 KIT (0.82) MAPK14KITLCKSRCLDLR

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
EP-1928844-A2 BIS-ARYL AMIDE COMPOUNDS AND METHODS OF USE Amgen, Inc (US) 2008-06-11 EP claimed
WO-2007022380-A2 BIS-ARYL AMIDE COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2007-02-22 WO claimed
EP-1928844-A2 BIS-ARYL AMIDE COMPOUNDS AND METHODS OF USE Amgen, Inc (US) 2008-06-11 EP disclosed
WO-2007022380-A2 BIS-ARYL AMIDE COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2007-02-22 WO disclosed