SCHEMBL8020728

SCHEMBL8020728

COc1ccccc1N(C)C(=O)COc1ccccc1N(CC(=O)N(C)c1ccccc1)C(=O)CN

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
KMT2A Q03164 5/20 0.43
MEN1 O00255 3/20 0.43
GAA P10253 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
MAPK1 P28482 1/20 0.42
NTSR1 P30989 1/20 0.42
HTT P42858 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
NOD2 Q9HC29 1/20 0.42
NOTUM Q6P988 1/20 0.41
PDE4D Q08499 1/20 0.39
POLB P06746 1/20 0.39
NPC1 O15118 1/20 0.38
MLYCD O95822 2/20 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
SCHEMBL8030560 0.93 KMT2A (0.47) ALDH1A1KMT2AMEN1GAASMN1; SMN2
SCHEMBL9134080 0.91 ALDH1A1 (0.47) ALDH1A1KMT2AMEN1POLB
SCHEMBL27488427 0.89 NOTUM (0.48) ALDH1A1KMT2AMEN1GAASMN1; SMN2
SCHEMBL8031940 0.89 KMT2A (0.42) ALDH1A1KMT2AMEN1GAASMN1; SMN2
SCHEMBL8032129 0.88 KMT2A (0.44) ALDH1A1KMT2AMEN1GAASMN1; SMN2
SCHEMBL8030133 0.87 ALDH1A1 (0.45) ALDH1A1KMT2AMEN1GAASMN1; SMN2
SCHEMBL27523449 0.87 KMT2A (0.47) ALDH1A1KMT2AMEN1GAASMN1; SMN2
SCHEMBL8036455 0.86 NOTUM (0.43) ALDH1A1KMT2AMEN1GAASMN1; SMN2
SCHEMBL8036352 0.85 KMT2A (0.43) ALDH1A1KMT2AMEN1GAASMN1; SMN2
SCHEMBL27489101 0.85 ALDH1A1 (0.41) ALDH1A1KMT2AMEN1GAASMN1; 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 3 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
US-5919824-A Aminophenol derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1999-07-06 US disclosed
CN-1178523-A Aminophenol derivatives DIICHI PHARMACEUTICAL CO LTD (JP) 1998-04-08 CN disclosed