SCHEMBL8661871

SCHEMBL8661871

COC(=O)c1ccc(NC(=O)CCC(=O)Nc2ccc(C(=O)OC)cc2)cc1

nearest known ligand 0.82

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.82
KMT2A Q03164 5/20 0.82
LMNA P02545 6/20 0.74
MAPT P10636 4/20 0.71
KDM4E B2RXH2 1/20 0.68
GAA P10253 1/20 0.67
RAB9A P51151 3/20 0.66
NPC1 O15118 1/20 0.66
GLA P06280 1/20 0.64
ATM Q13315 1/20 0.64
NPSR1 Q6W5P4 1/20 0.64
ALDH1A1 P00352 3/20 0.64
HPGD P15428 2/20 0.64
MAPK1 P28482 2/20 0.62
TP53 P04637 1/20 0.61
GRK2 P25098 1/20 0.61
RECQL P46063 1/20 0.61

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
SCHEMBL14155989 0.91 MEN1 (0.74) MEN1KMT2ALMNAMAPTKDM4E
SCHEMBL25230453 0.90 MEN1 (0.72) MEN1KMT2ALMNAMAPTKDM4E
SCHEMBL9198473 0.88 MEN1 (0.70) MEN1KMT2ALMNAMAPTKDM4E
SCHEMBL2351620 0.87 MEN1 (0.79) MEN1KMT2ALMNAMAPTKDM4E
SCHEMBL8401925 0.87 KMT2A (0.79) MEN1KMT2ALMNAMAPTGAA
SCHEMBL12535778 0.87 MEN1 (0.68) MEN1KMT2ALMNAMAPTKDM4E
SCHEMBL27909127 0.87 MEN1 (0.68) MEN1KMT2ALMNAMAPTKDM4E
SCHEMBL2839586 0.87 MEN1 (0.68) MEN1KMT2ALMNAMAPTKDM4E
SCHEMBL21998667 0.85 MEN1 (0.66) MEN1KMT2ALMNAMAPTRAB9A
SCHEMBL15061987 0.85 MEN1 (0.66) MEN1KMT2ALMNAMAPTKDM4E

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0724568-B1 AMIDO PEROXYCARBOXYLIC ACIDS FOR BLEACHING UNILEVER PLC (GB) 1998-11-04 EP disclosed
EP-0724568-A1 AMIDO PEROXYCARBOXYLIC ACIDS FOR BLEACHING UNILEVER PLC (GB) 1996-08-07 EP disclosed
EP-0564251-B1 Amido peroxycarboxylic acids UNILEVER PLC (GB) 1995-09-06 EP disclosed
US-5397501-A Composition with surfactants for bleaching fabrics LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1995-03-14 US disclosed
WO-1995003275-A1 AMIDO PEROXYCARBOXYLIC ACIDS FOR BLEACHING UNILEVER N.V. (NL) 1995-02-02 WO disclosed
US-5268003-A Or salt thereof LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1993-12-07 US disclosed
EP-0564251-A2 Amido peroxycarboxylic acids UNILEVER PLC (GB) 1993-10-06 EP disclosed
EP-0564250-A2 Structured liquid detergent compositions containing amido and imido peroxy acids UNILEVER PLC (GB) 1993-10-06 EP disclosed