SCHEMBL9717494

SCHEMBL9717494

O=S(=O)(O)c1ccc(Nc2ccccc2)cc1.O=S(=O)(O)c1cccc(Nc2ccccc2)c1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SNCA P37840 2/20 0.76
NSD2 O96028 1/20 0.60
DUSP3 P51452 1/20 0.60
PTPN5 P54829 1/20 0.60
CASP7 P55210 1/20 0.60
CASP6 P55212 1/20 0.60
PTPN11 Q06124 1/20 0.60
TSHR P16473 4/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
ALDH1A1 P00352 4/20 0.50
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
TNNI3 P19429 1/20 0.50
TNNT2 P45379 1/20 0.50
TNNC1 P63316 1/20 0.50
HKDC1 Q2TB90 1/20 0.50
PTPRA P18433 1/20 0.50
PTPRB P23467 1/20 0.50
AR P10275 1/20 0.50
MAPT P10636 1/20 0.50

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
SCHEMBL6865288 0.95 SNCA (0.72) SNCANSD2DUSP3PTPN5CASP7
SCHEMBL10791668 0.89 SNCA (0.69) SNCANSD2DUSP3PTPN5CASP7
SCHEMBL9479439 0.89 SNCA (0.73) SNCANSD2DUSP3PTPN5CASP7
SCHEMBL315795 0.89 SNCA (0.73) SNCANSD2DUSP3PTPN5CASP7
Diphenylamine SCHEMBL28417536 0.87 TSHR (0.73) SNCANSD2DUSP3PTPN5CASP7
SCHEMBL29843770 0.86 SNCA (1.00) SNCANSD2DUSP3PTPN5CASP7
SCHEMBL278412 0.86 SNCA (1.00) SNCANSD2DUSP3PTPN5CASP7
SCHEMBL29668447 0.86 SNCA (1.00) SNCANSD2DUSP3PTPN5CASP7
SCHEMBL10490044 0.85 SNCA (0.59) SNCANSD2DUSP3PTPN5CASP7
SCHEMBL2129185 0.85 SNCA (0.90) SNCANSD2DUSP3PTPN5CASP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0466902-A4 STABILIZATION OF AQUEOUS PEROXYGEN SOLUTIONS 1992-05-20 EP disclosed
EP-0466902-A1 STABILIZATION OF AQUEOUS SOLUTIONS CONTAINING SODIUM PERBORATE OR SODIUM PERCARBONATE UNITED STATES BORAX & CHEMICAL CORPORATION (US) 1992-01-22 EP disclosed
WO-1991011388-A1 STABILIZATION OF AQUEOUS PEROXYGEN SOLUTIONS UNITED STATES BORAX & CHEMICAL CORPORATION (US) 1991-08-08 WO disclosed