SCHEMBL8030366

SCHEMBL8030366

CC(=NO)c1cccc(NC(=O)NCC(=O)N(CC(=O)N(C)c2ccccc2)c2ccccc2OCC(=O)N(C)c2ccccc2)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
GAA P10253 1/20 0.38
BDKRB2 P30411 7/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
MAPK1 P28482 1/20 0.38
NTSR1 P30989 1/20 0.38
HTT P42858 1/20 0.38
NOD2 Q9HC29 1/20 0.38
NPC1 O15118 1/20 0.36
MITF O75030 1/20 0.36
NFKB1 P19838 1/20 0.36
RAB9A P51151 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
PAX8 Q06710 1/20 0.36
KLF5 Q13887 1/20 0.36

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
SCHEMBL8030284 0.93 MAPT (0.46) ALDH1A1MAPTKMT2AMEN1GAA
SCHEMBL8036825 0.88 BDKRB2 (0.42) ALDH1A1MAPTKMT2AMEN1GAA
SCHEMBL9157339 0.87 KMT2A (0.42) ALDH1A1MAPTKMT2AMEN1SMN1; SMN2
SCHEMBL9157333 0.87 KMT2A (0.42) ALDH1A1MAPTKMT2AMEN1SMN1; SMN2
SCHEMBL9157342 0.87 KMT2A (0.42) ALDH1A1MAPTKMT2AMEN1SMN1; SMN2
SCHEMBL8030026 0.87 BDKRB2 (0.43) MAPTKMT2AMEN1GAABDKRB2
SCHEMBL8030207 0.85 KMT2A (0.44) ALDH1A1MAPTKMT2AMEN1GAA
SCHEMBL8033894 0.84 SMN1; SMN2 (0.41) MAPTKMT2AMEN1GAABDKRB2
SCHEMBL8033880 0.84 KMT2A (0.44) KMT2AMEN1GAASMN1; SMN2NPSR1
SCHEMBL8031817 0.84 TAAR1 (0.44) MAPTKMT2AMEN1GAASMN1; 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 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