SCHEMBL5344218

SCHEMBL5344218

O=C1C=Cc2cc(S(=O)(=O)O)ccc2C1=NNc1ccc(S(=O)(=O)O)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
EIF2AK2 P19525 1/20 0.35
SNCA P37840 2/20 0.34
GAA P10253 2/20 0.33
LMNA P02545 2/20 0.33
MAPT P10636 2/20 0.33
PTPRC P08575 2/20 0.33
TIMP3 P35625 1/20 0.33
PTPN1 P18031 1/20 0.32
PTPN6 P29350 1/20 0.32
PTPN11 Q06124 1/20 0.32
HTT P42858 1/20 0.32
CACNA1B Q00975 1/20 0.31
APBA1 Q02410 1/20 0.31
MCL1 Q07820 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP2C19 P33261 1/20 0.30
THRB P10828 1/20 0.30
APEX1 P27695 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
SCHEMBL5344213 1.00 MEN1 (0.37) MEN1KMT2AEIF2AK2SNCAGAA
SCHEMBL21784230 0.91 GAA (0.45) MEN1KMT2AGAAMAPTPTPRC
SCHEMBL17460447 0.87 MEN1 (0.41) MEN1KMT2AEIF2AK2SNCAGAA
SCHEMBL10053808 0.87 MEN1 (0.41) MEN1KMT2AEIF2AK2SNCAGAA
SCHEMBL17460446 0.87 MEN1 (0.41) MEN1KMT2AEIF2AK2SNCAGAA
SCHEMBL340828 0.84 EIF2AK2 (0.35) EIF2AK2GAALMNAMAPTPTPRC
SCHEMBL15195813 0.84 PTPRC (0.34) MEN1KMT2ASNCAPTPRCTHRB
SCHEMBL17762728 0.82 SNCA (0.41) MEN1KMT2AEIF2AK2SNCAGAA
SCHEMBL2858004 0.81 POLB (0.46) MEN1KMT2AEIF2AK2GAALMNA
SCHEMBL8995419 0.80 POLB (0.41) MEN1KMT2ALMNAMAPTPTPRC

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
US-20070261436-A1 DRY ICE PRODUCTS AND METHOD OF MAKING SAME SUNDARAM MEENAKSHI 2007-11-15 US disclosed
WO-2007088442-A1 DRY ICE PRODUCTS AND METHOD OF MAKING SAME L'AIR LIQUIDE-SOCIETE ANONYME POUR L'ETUDE ET L'EXPLOITATION DES PROCEDES GEORGES CLAUDE (US) 2007-08-09 WO disclosed