SCHEMBL6801477

SCHEMBL6801477

Cc1[nH]n(-c2ccccc2)c(=O)c1C(=O)C(C)(C)C.Cc1[nH]n(-c2ccccc2)c(=O)c1C(=O)C(C)(C)C.Cc1[nH]n(-c2ccccc2)c(=O)c1C(=O)C(C)(C)C.[Eu]

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.60
MEN1 O00255 6/20 0.60
NPSR1 Q6W5P4 3/20 0.59
KDM4E B2RXH2 3/20 0.57
MAPT P10636 7/20 0.56
ALDH1A1 P00352 3/20 0.54
LMNA P02545 2/20 0.54
GAA P10253 5/20 0.52
ALOX15 P16050 2/20 0.51
HTT P42858 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.48
ABCB1 P08183 1/20 0.47
TDP1 Q9NUW8 2/20 0.47
APAF1 O14727 1/20 0.47
TDP2 O95551 1/20 0.47
THRB P10828 1/20 0.47
HPGD P15428 1/20 0.47
ATM Q13315 1/20 0.47
NPC1 O15118 1/20 0.47
POLB P06746 1/20 0.47

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
SCHEMBL6806109 0.98 KMT2A (0.62) KMT2AMEN1NPSR1KDM4EMAPT
SCHEMBL1262765 0.98 KMT2A (0.62) KMT2AMEN1NPSR1KDM4EMAPT
SCHEMBL1660934 0.97 KMT2A (0.60) KMT2AMEN1NPSR1KDM4EMAPT
SCHEMBL27910734 0.97 KMT2A (0.60) KMT2AMEN1NPSR1KDM4EMAPT
SCHEMBL6798596 0.97 KMT2A (0.60) KMT2AMEN1NPSR1KDM4EMAPT
SCHEMBL29409923 0.97 KMT2A (0.60) KMT2AMEN1NPSR1KDM4EMAPT
SCHEMBL9781114 0.85 KMT2A (0.60) KMT2AMEN1NPSR1KDM4EMAPT
SCHEMBL5818776 0.85 MAPT (0.58) KMT2AMEN1NPSR1KDM4EMAPT
SCHEMBL29843297 0.83 KMT2A (0.68) KMT2AMEN1NPSR1KDM4EMAPT
SCHEMBL5367920 0.81 KMT2A (0.67) KMT2AMEN1NPSR1KDM4EMAPT

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
US-20040027821-A1 Pyrazolone lanthanide complexes ISIS INNOVATION LIMITED (GB) 2004-02-12 US disclosed