SCHEMBL5070732

SCHEMBL5070732

N#Cc1ccc(NC(=O)c2cccc(OCc3ccccc3)c2OCc2ccccc2)nc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SGMS2 Q8NHU3 5/20 0.55
TMPRSS4 Q9NRS4 1/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
GCK P35557 2/20 0.46
GAA P10253 1/20 0.46
PPIA P62937 1/20 0.46
CXCR2 P25025 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
SIRT2 Q8IXJ6 1/20 0.43
LRRK2 Q5S007 2/20 0.43

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
SCHEMBL27613370 0.91 SGMS2 (0.65) SGMS2TMPRSS4MEN1KMT2AGCK
SCHEMBL1793859 0.78 GCK (0.73) MEN1KMT2AGCKCXCR2SIRT2
SCHEMBL18132564 0.77 MEN1 (0.59) TMPRSS4MEN1KMT2AGAATDP1
SCHEMBL5065006 0.75 SGMS2 (0.48) SGMS2MEN1KMT2AGCKGAA
SCHEMBL7345966 0.74 GCK (0.72) SGMS2MEN1KMT2AGCKGAA
SCHEMBL31110211 0.74 MEN1 (0.57) TMPRSS4MEN1KMT2AGAATDP1
SCHEMBL2653573 0.73 GCK (0.55) SGMS2MEN1KMT2AGCKGAA
SCHEMBL31665350 0.73 MEN1 (0.54) TMPRSS4MEN1KMT2AGAA
SCHEMBL1967584 0.73 HCAR3 (0.63) TMPRSS4MEN1KMT2ASIRT2
SCHEMBL15824583 0.72 SMPD1 (0.61) MEN1KMT2AGCKCXCR2SIRT2

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-1661568-B1 Compounds effecting Glucokinase ASTRAZENECA AB (SE) 2008-09-03 EP disclosed
EP-1674097-B1 Compounds effecting glucokinase ASTRAZENECA AB (SE) 2008-06-11 EP disclosed