SCHEMBL14067253

SCHEMBL14067253

CN(C)CC(=O)Nc1ccc2c(c1)CCN2CO

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.44
ALDH1A1 P00352 4/20 0.44
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
ALOX5 P09917 4/20 0.43
EPHX2 P34913 3/20 0.43
KCNT1 Q5JUK3 1/20 0.43
POLB P06746 1/20 0.43
NPY5R Q15761 1/20 0.43
NAMPT P43490 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
LMNA P02545 1/20 0.42
HPGD P15428 1/20 0.42
PARP1 P09874 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
AAK1 Q2M2I8 1/20 0.41
KDM4E B2RXH2 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
SCHEMBL14590670 0.82 TP53 (0.60) MAPTMEN1KMT2ALMNAHPGD
SCHEMBL14626021 0.81 NAMPT (0.42) MAPTALDH1A1MEN1KMT2ANPY5R
SCHEMBL6109559 0.77 NPC1 (0.45) MAPTALDH1A1MEN1KMT2APOLB
SCHEMBL14590662 0.75 NOTUM (0.52) MAPTMEN1KMT2APOLBLMNA
SCHEMBL14626017 0.74 MAPT (0.47) MAPTALDH1A1MEN1KMT2APOLB
SCHEMBL14067059 0.74 HPGD (0.47) MEN1KMT2AALOX5EPHX2KCNT1
SCHEMBL2632813 0.72 ALDH1A1 (0.52) MAPTALDH1A1MEN1KMT2AALOX5
SCHEMBL14067273 0.72 ALDH1A1 (0.54) MAPTALDH1A1MEN1KMT2APOLB
SCHEMBL4716271 0.70 ITGB3 (0.56) MAPTALDH1A1MEN1KMT2ANPY5R
SCHEMBL14067235 0.70 NAMPT (0.61) MAPTALDH1A1MEN1KMT2ANPY5R

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
EP-1325910-B1 ALIPHATIC NITROGENOUS FIVE-MEMBERED RING COMPOUNDS MITSUBISHI TANABE PHARMA CORP (JP) 2008-09-17 EP disclosed