SCHEMBL8036455

SCHEMBL8036455

Cc1cc(C)cc(N(C)C(=O)COc2ccccc2N(CC(=O)N(C)c2ccccc2)C(=O)CN)c1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.43
KMT2A Q03164 8/20 0.42
MEN1 O00255 7/20 0.42
GAA P10253 1/20 0.42
MAPK1 P28482 1/20 0.41
NTSR1 P30989 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
NOD2 Q9HC29 1/20 0.41
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 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
SCHEMBL8036352 0.93 KMT2A (0.43) NOTUMKMT2AMEN1GAAMAPK1
SCHEMBL8030560 0.92 KMT2A (0.47) NOTUMKMT2AMEN1GAAMAPK1
SCHEMBL27488427 0.88 NOTUM (0.48) NOTUMKMT2AMEN1GAAMAPK1
SCHEMBL8031940 0.88 KMT2A (0.42) NOTUMKMT2AMEN1GAAMAPK1
SCHEMBL8020728 0.86 ALDH1A1 (0.46) NOTUMKMT2AMEN1GAAMAPK1
SCHEMBL27489101 0.86 ALDH1A1 (0.41) NOTUMKMT2AMEN1GAAMAPK1
SCHEMBL27523449 0.86 KMT2A (0.47) NOTUMKMT2AMEN1GAAMAPK1
SCHEMBL8032129 0.85 KMT2A (0.44) KMT2AMEN1GAAMAPK1NTSR1
SCHEMBL8033749 0.83 MLYCD (0.43) KMT2AMEN1MAPK1NTSR1HTT
SCHEMBL9134080 0.81 ALDH1A1 (0.47) KMT2AMEN1ALDH1A1

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