SCHEMBL8036825

SCHEMBL8036825

CC(=O)c1cccc(NC(=O)NCC(=O)N(CC(=O)N(C)c2ccccc2)c2ccccc2OCC(=O)N(C)c2cc(C)cc(C)c2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 5/20 0.42
MAPT P10636 2/20 0.42
ALDH1A1 P00352 1/20 0.42
KMT2A Q03164 5/20 0.39
MEN1 O00255 3/20 0.39
SMN1; SMN2 Q16637 4/20 0.38
NPC1 O15118 4/20 0.38
RAB9A P51151 4/20 0.38
TSHR P16473 2/20 0.38
MITF O75030 1/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
PAX8 Q06710 1/20 0.38
KLF5 Q13887 1/20 0.38
GAA P10253 1/20 0.38
NPSR1 Q6W5P4 2/20 0.37
MAPK1 P28482 1/20 0.37
NTSR1 P30989 1/20 0.37
HTT P42858 1/20 0.37

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 0.95 MAPT (0.46) BDKRB2MAPTALDH1A1KMT2AMEN1
SCHEMBL8030385 0.93 BDKRB2 (0.41) BDKRB2MAPTKMT2AMEN1SMN1; SMN2
SCHEMBL8020864 0.92 KMT2A (0.39) BDKRB2ALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL8020963 0.90 KMT2A (0.41) BDKRB2MAPTKMT2AMEN1SMN1; SMN2
SCHEMBL8030026 0.89 BDKRB2 (0.43) BDKRB2MAPTKMT2AMEN1SMN1; SMN2
SCHEMBL8020734 0.89 KMT2A (0.40) BDKRB2KMT2AMEN1SMN1; SMN2GAA
SCHEMBL8033965 0.88 KMT2A (0.42) BDKRB2KMT2AMEN1SMN1; SMN2GAA
SCHEMBL8032087 0.88 KMT2A (0.38) BDKRB2KMT2AMEN1SMN1; SMN2GAA
SCHEMBL8036298 0.88 KMT2A (0.42) BDKRB2KMT2AMEN1SMN1; SMN2GAA
SCHEMBL8030366 0.88 ALDH1A1 (0.38) BDKRB2MAPTALDH1A1KMT2AMEN1

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