SCHEMBL4060036

SCHEMBL4060036

C=C(OC(=O)N(C)C)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.47
KDM4E B2RXH2 2/20 0.47
USP2 O75604 1/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
MAPT P10636 4/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
HPGD P15428 2/20 0.44
PDCD1 Q15116 1/20 0.44
CD274 Q9NZQ7 1/20 0.44
KMT2A Q03164 2/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
MEN1 O00255 1/20 0.42
PKM P14618 1/20 0.41
AGTR1 P30556 1/20 0.41
TSPO P30536 1/20 0.41
ERCC5 P28715 1/20 0.41
FEN1 P39748 1/20 0.41
HAO1 Q9UJM8 1/20 0.41
CTDSP1 Q9GZU7 1/20 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
SCHEMBL1683356 0.90 KMT2A (0.50) ALDH1A1KDM4ESMN1; SMN2MAPTHPGD
SCHEMBL4058318 0.86 SMN1; SMN2 (0.49) ALDH1A1KDM4EUSP2SMN1; SMN2MAPT
SCHEMBL4055614 0.86 KMO (0.49) ALDH1A1MAPTHPGDKMT2APKM
SCHEMBL4056676 0.77 KDM4E (0.49) KDM4ESMN1; SMN2MAPTL3MBTL1HPGD
SCHEMBL4060030 0.74 HDAC2 (0.49)
SCHEMBL4052576 0.73 KMO (0.45) ALDH1A1SMN1; SMN2MAPTL3MBTL1NPC1
SCHEMBL2047793 0.72 HPGD (0.63) ALDH1A1KDM4EUSP2SMN1; SMN2MAPT
SCHEMBL4064114 0.72 PTPN1 (0.54) ALDH1A1SMN1; SMN2KMT2ANPC1RAB9A
SCHEMBL30738654 0.72 RAB9A (0.73) ALDH1A1SMN1; SMN2L3MBTL1KMT2ANPC1
SCHEMBL4318071 0.71 SMN1; SMN2 (0.54) ALDH1A1KDM4EUSP2SMN1; SMN2MAPT

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
WO-2009109504-A1 ENOL CARBAMATE DERIVATIVES AS MODULATORS OF FATTY ACID AMIDE HYDROLASE SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2009-09-11 WO disclosed
WO-2009109504-A1 ENOL CARBAMATE DERIVATIVES AS MODULATORS OF FATTY ACID AMIDE HYDROLASE SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2009-09-11 WO disclosed