SCHEMBL4599074

SCHEMBL4599074

CC(C)C(=O)NOc1ccc(Cl)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
FFAR2 O15552 1/20 0.42
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HPGD P15428 1/20 0.42
MMP2 P08253 1/20 0.41
MMP9 P14780 1/20 0.41
MAPT P10636 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
PPARA Q07869 1/20 0.41
OGG1 O15527 1/20 0.41
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL29054088 0.81 METAP2 (0.55) ALDH1A1KMT2AMEN1RAB9ASMN1; SMN2
SCHEMBL16392373 0.79 KMT2A (0.47) ALDH1A1KMT2AMEN1RAB9ASMN1; SMN2
SCHEMBL4689285 0.74 MEN1 (0.45) ALDH1A1KMT2AMEN1SMN1; SMN2HPGD
SCHEMBL14521772 0.72 L3MBTL1 (0.60) ALDH1A1KMT2AMEN1SMN1; SMN2PPARA
SCHEMBL6761506 0.71 ALDH1A1 (0.71) ALDH1A1KMT2AMEN1SMN1; SMN2MAPT
SCHEMBL4185924 0.71 ELANE (0.66) ALDH1A1KMT2AMEN1SMN1; SMN2HPGD
SCHEMBL5227347 0.71 ALDH1A1 (0.61) ALDH1A1FFAR2KMT2AMEN1RAB9A
SCHEMBL7841594 0.71 ALDH1A1 (0.39) ALDH1A1KMT2AMEN1RAB9ASMN1; SMN2
SCHEMBL10631768 0.71 XIAP (0.49) ALDH1A1KMT2AMEN1SMN1; SMN2MAPT
SCHEMBL5670691 0.70 EPHX1 (0.42) ALDH1A1KMT2AMEN1RAB9ASMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1910309-A2 CYCLOALKYL AMINO-HYDANTOIN COMPOUNDS AND USE THEREOF FOR ß-SECRETASE MODULATION Wyeth (US) 2008-04-16 EP claimed
WO-2007016012-A2 CYCLOALKYL AMINO-HYDANTOIN COMPOUNDS AND USE THEREOF FOR β-SECRETASE MODULATION WYETH (US) 2007-02-08 WO claimed
EP-1910309-A2 CYCLOALKYL AMINO-HYDANTOIN COMPOUNDS AND USE THEREOF FOR ß-SECRETASE MODULATION Wyeth (US) 2008-04-16 EP disclosed
WO-2007016012-A2 CYCLOALKYL AMINO-HYDANTOIN COMPOUNDS AND USE THEREOF FOR β-SECRETASE MODULATION WYETH (US) 2007-02-08 WO disclosed