SCHEMBL4648903

SCHEMBL4648903

NC(=O)N/N=C1\C=Cc2ccc(Br)cc2C1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.39
KDM4E B2RXH2 1/20 0.39
GAA P10253 1/20 0.39
PTPRC P08575 2/20 0.36
S100A4 P26447 1/20 0.35
BCL2 P10415 1/20 0.34
MCL1 Q07820 1/20 0.34
CTSL P07711 3/20 0.33
TGM2 P21980 1/20 0.33
CES1 P23141 1/20 0.33
MEN1 O00255 1/20 0.33
EDNRB P24530 1/20 0.33
EDNRA P25101 1/20 0.33
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA4 P22748 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 0.31
PLAU P00749 1/20 0.31
DGAT1 O75907 1/20 0.30

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
SCHEMBL4648906 1.00 KMT2A (0.39) KMT2AKDM4EGAAPTPRCS100A4
SCHEMBL4648731 0.89 KMT2A (0.39) KMT2AKDM4EGAAPTPRCS100A4
SCHEMBL4648727 0.89 KMT2A (0.39) KMT2AKDM4EGAAPTPRCS100A4
Naftazone SCHEMBL1697156 0.80 MEN1 (0.44) KMT2AKDM4EGAAPTPRCCES1
Naftazone SCHEMBL4648800 0.80 MEN1 (0.44) KMT2AKDM4EGAAPTPRCCES1
Naftazone SCHEMBL29615756 0.80 MEN1 (0.44) KMT2AKDM4EGAAPTPRCCES1
SCHEMBL14101161 0.75 KMT2A (0.36) KMT2AKDM4EGAAMEN1
SCHEMBL4646829 0.73 KDM4E (0.40) KMT2AKDM4EGAAMEN1
SCHEMBL4646835 0.73 KDM4E (0.40) KMT2AKDM4EGAAMEN1
SCHEMBL4648045 0.72 PTPRC (0.40) KMT2AKDM4EGAAPTPRCMEN1

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-1961738-A1 New compounds with antiglutamatergic properties and uses thereof Faust Pharmaceuticals (FR) 2008-08-27 EP disclosed
WO-2008098751-A1 NEW COMPOUNDS WITH ANTIGLUTAMATERGIC PROPERTIES AND USES THEREOF FAUST PHARMACEUTICALS (FR) 2008-08-21 WO disclosed