SCHEMBL7060833

SCHEMBL7060833

CC(C)(C)ON(C=O)Cc1cccc(N)n1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 4/20 0.34
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.34
NOS2 P35228 3/20 0.33
NOS3 P29474 3/20 0.33
APP P05067 1/20 0.33
NOS1 P29475 4/20 0.33
IDH1 O75874 1/20 0.31
MCHR1 Q99705 2/20 0.31
XIAP P98170 1/20 0.31
BIRC2 Q13490 1/20 0.31
ITGB3 P05106 1/20 0.31
ITGAV P06756 1/20 0.31
ITGA2B P08514 1/20 0.31
CPB2 Q96IY4 1/20 0.30

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
SCHEMBL4518626 0.73 HSD11B1 (0.38)
SCHEMBL5662615 0.72 LOXL2 (0.35) KDM4EMAPTNOS2NOS3NOS1
SCHEMBL643420 0.72 MAPT (0.38) MAPTITGB3ITGAV
SCHEMBL30912531 0.71 HTR2C (0.45) BACE1KDM4EMAPTXIAPBIRC2
SCHEMBL7763429 0.71 MEN1 (0.41)
SCHEMBL5663890 0.71 LOXL2 (0.38) NOS2NOS3NOS1
SCHEMBL11065856 0.70 NOS2 (0.45) BACE1NOS2NOS3APPNOS1
SCHEMBL15295454 0.69 BACE1 (0.44) BACE1MAPTNOS2NOS3APP
SCHEMBL6369215 0.69 KDM4E (0.37) KDM4E
SCHEMBL5345645 0.69 XIAP (0.38) BACE1KDM4EMAPTMCHR1XIAP

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
EP-1309589-A2 UREA COMPOUNDS AND METHODS OF USES Amgen Inc. (US) 2003-05-14 EP disclosed
WO-2002014311-A2 UREA COMPOUNDS AND METHODS OF USES AMGEN INC. (US) 2002-02-21 WO disclosed