SCHEMBL14626017

SCHEMBL14626017

CN(C)CC(=O)Nc1ccc2c(c1)N(C=O)CC2

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.47
KDM4E B2RXH2 1/20 0.47
NR1I3 Q14994 2/20 0.43
SLC6A2 P23975 1/20 0.43
SLC6A4 P31645 1/20 0.43
KMT2A Q03164 3/20 0.42
ALDH1A1 P00352 2/20 0.42
NAMPT P43490 1/20 0.42
ESR1 P03372 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
POLB P06746 1/20 0.42
NPY5R Q15761 1/20 0.42
PRKCQ Q04759 1/20 0.41
MEN1 O00255 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
LMNA P02545 1/20 0.41
PARP1 P09874 2/20 0.41
AAK1 Q2M2I8 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
SCHEMBL14626021 0.90 NAMPT (0.42) MAPTKDM4EKMT2AALDH1A1NAMPT
SCHEMBL14626054 0.84 APEX1 (0.44) MAPTKDM4ENR1I3ALDH1A1L3MBTL1
SCHEMBL14625894 0.82 L3MBTL1 (0.54) MAPTKDM4ESLC6A2SLC6A4KMT2A
SCHEMBL14590662 0.81 NOTUM (0.52) MAPTKDM4EKMT2ASMN1; SMN2POLB
SCHEMBL14626443 0.80 KMT2A (0.46) MAPTKDM4ENR1I3KMT2AALDH1A1
SCHEMBL14625858 0.76 NAMPT (0.54) MAPTKDM4EKMT2AALDH1A1NAMPT
SCHEMBL14067253 0.74 MAPT (0.44) MAPTKDM4EKMT2AALDH1A1NAMPT
SCHEMBL14590670 0.74 TP53 (0.60) MAPTKMT2ASMN1; SMN2MEN1LMNA
SCHEMBL14626226 0.73 APEX1 (0.44) MAPTALDH1A1SMN1; SMN2
SCHEMBL14626247 0.72 GAA (0.46) KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7160877-B2 Aliphatic nitrogen-containing 5-membered ring compound TANABE SEIYAKU CO., LTD. (JP) 2007-01-09 US disclosed