SCHEMBL8033932

SCHEMBL8033932

COC(=O)Cc1cccc(NC(=O)NCC(=O)N(CC(=O)N(C)c2ccccc2)c2ccccc2OCC(=O)N(C)c2ccccc2C)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39
NOTUM Q6P988 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
MAPK1 P28482 1/20 0.35
NTSR1 P30989 1/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
NOD2 Q9HC29 1/20 0.35
BDKRB2 P30411 5/20 0.35
ITGB1 P05556 2/20 0.35
ITGA4 P13612 2/20 0.35
PPIB P23284 1/20 0.35
POLB P06746 1/20 0.34
NPC1 O15118 1/20 0.34
MITF O75030 1/20 0.34
NFKB1 P19838 1/20 0.34
RAB9A P51151 1/20 0.34
NFKB2 Q00653 1/20 0.34

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
SCHEMBL8032081 0.96 KMT2A (0.38) KMT2AMEN1GAANOTUMSMN1; SMN2
SCHEMBL8030377 0.95 KMT2A (0.39) KMT2AMEN1GAANOTUMSMN1; SMN2
SCHEMBL8033739 0.95 KMT2A (0.42) KMT2AMEN1GAASMN1; SMN2MAPK1
SCHEMBL8030447 0.94 KMT2A (0.37) KMT2AMEN1GAASMN1; SMN2MAPK1
SCHEMBL8020517 0.94 KMT2A (0.40) KMT2AMEN1GAANOTUMSMN1; SMN2
SCHEMBL8029577 0.93 KMT2A (0.40) KMT2AMEN1GAASMN1; SMN2MAPK1
SCHEMBL27489100 0.93 KMT2A (0.37) KMT2AMEN1GAANOTUMSMN1; SMN2
SCHEMBL8031893 0.93 KMT2A (0.39) KMT2AMEN1GAASMN1; SMN2MAPK1
SCHEMBL8036472 0.93 KMT2A (0.39) KMT2AMEN1GAASMN1; SMN2MAPK1
SCHEMBL8030267 0.90 KMT2A (0.42) KMT2AMEN1GAASMN1; SMN2MAPK1

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 2 patents. 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
CN-1178523-A Aminophenol derivatives DIICHI PHARMACEUTICAL CO LTD (JP) 1998-04-08 CN disclosed