SCHEMBL8034158

SCHEMBL8034158

CN(C(=O)COc1ccccc1N(CCc1ccccc1)C(=O)CNC(=O)Nc1cccc(CC(=O)O)c1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.47
MEN1 O00255 3/20 0.47
GAA P10253 2/20 0.47
MAPK1 P28482 1/20 0.38
NTSR1 P30989 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
NOD2 Q9HC29 1/20 0.38
PPIB P23284 1/20 0.38
HPSE Q9Y251 1/20 0.37
ALDH1A1 P00352 1/20 0.37
ALOX15 P16050 1/20 0.37
LTB4R Q15722 5/20 0.36
LTB4R2 Q9NPC1 5/20 0.36
ITGB1 P05556 1/20 0.36
ITGA4 P13612 1/20 0.36
NPC1 O15118 1/20 0.35
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL8033748 0.92 KMT2A (0.41) KMT2AMEN1GAAMAPK1NTSR1
SCHEMBL8030586 0.92 KMT2A (0.44) KMT2AMEN1GAAMAPK1NTSR1
SCHEMBL8033880 0.92 KMT2A (0.44) KMT2AMEN1GAAMAPK1NTSR1
SCHEMBL8030196 0.91 KMT2A (0.41) KMT2AMEN1GAAMAPK1NTSR1
SCHEMBL8020809 0.90 KMT2A (0.40) KMT2AMEN1GAAMAPK1NTSR1
SCHEMBL8030535 0.90 KMT2A (0.40) KMT2AMEN1GAAMAPK1NTSR1
SCHEMBL8020876 0.90 KMT2A (0.42) KMT2AMEN1GAAMAPK1NTSR1
SCHEMBL8020970 0.90 KMT2A (0.40) KMT2AMEN1GAAMAPK1NTSR1
SCHEMBL8033897 0.90 KMT2A (0.43) KMT2AMEN1GAAMAPK1NTSR1
SCHEMBL8030024 0.89 KMT2A (0.42) KMT2AMEN1GAAMAPK1NTSR1

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-0985660-A1 AMINOPHENOL DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2000-03-15 EP disclosed