SCHEMBL8186743

SCHEMBL8186743

CC(C(=O)N(N)C(=O)OC(C)(C)C)c1cc(/N=N/c2ccccc2C(=O)O)ccc1O.CC(C(=O)NCCCCCCO)c1cc(/N=N/c2ccccc2C(=O)O)ccc1O

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.42
MAPT P10636 4/20 0.42
KMT2A Q03164 4/20 0.42
NPSR1 Q6W5P4 3/20 0.42
GAA P10253 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
TDP1 Q9NUW8 3/20 0.34
MAPK1 P28482 2/20 0.34
MYC P01106 1/20 0.33
IDE P14735 1/20 0.33
PTPN1 P18031 8/20 0.32
PTPRA P18433 1/20 0.32
PSMD14 O00487 1/20 0.31
HSP90AA1 P07900 1/20 0.31
MMP2 P08253 1/20 0.31
THRB P10828 1/20 0.31
PTPN22 Q9Y2R2 1/20 0.31
GLO1 Q04760 1/20 0.30
PHLPP2 Q6ZVD8 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
SCHEMBL6812525 0.90 MEN1 (0.43) MEN1MAPTKMT2ANPSR1GAA
SCHEMBL6808674 0.87 MEN1 (0.51) MEN1MAPTKMT2ANPSR1GAA
SCHEMBL6807136 0.87 MEN1 (0.51) MEN1MAPTKMT2ANPSR1GAA
SCHEMBL5425082 0.82 MEN1 (0.50) MEN1MAPTKMT2ANPSR1GAA
SCHEMBL5418551 0.80 MEN1 (0.50) MEN1MAPTKMT2ANPSR1GAA
SCHEMBL6806511 0.79 MEN1 (0.47) MEN1MAPTKMT2ANPSR1GAA
SCHEMBL7129511 0.75 MEN1 (0.45) MEN1MAPTKMT2ANPSR1GAA
SCHEMBL5409453 0.74 MEN1 (0.44) MEN1MAPTKMT2ANPSR1GAA
SCHEMBL6806131 0.73 MEN1 (0.56) MEN1MAPTKMT2ANPSR1GAA
SCHEMBL8186748 0.71 MAPT (0.46) MEN1MAPTKMT2ANPSR1GAA

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
WO-2000027813-A1 AZOBENZENE DERIVATIVES AS LABELING AGENTS AND INTERMEDIATES THEREOF YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2000-05-18 WO claimed