SCHEMBL8003873

SCHEMBL8003873

O=C(O)C1=NN(c2ccc(S(=O)(=O)O)cc2)C(=O)C1.[NaH]

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.66
MMP9 P14780 1/20 0.51
GAA P10253 4/20 0.45
MAPT P10636 5/20 0.43
KMT2A Q03164 5/20 0.43
KDM4E B2RXH2 5/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
ALDH1A1 P00352 5/20 0.42
LMNA P02545 2/20 0.42
CASP6 P55212 2/20 0.40
LOX P28300 1/20 0.39
MEN1 O00255 3/20 0.39
CA12 O43570 2/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA9 Q16790 2/20 0.39
TDP1 Q9NUW8 3/20 0.39
CYP1A2 P05177 1/20 0.39
CHRM2 P08172 1/20 0.39

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
SCHEMBL1715679 0.99 POLB (0.68) POLBMMP9GAAMAPTKMT2A
SCHEMBL3131292 0.97 POLB (0.66) POLBMMP9GAAMAPTKMT2A
SCHEMBL10654200 0.91 POLB (0.58) POLBMMP9GAAMAPTKMT2A
SCHEMBL8003872 0.86 POLB (0.66) POLBMMP9GAAMAPTKMT2A
SCHEMBL11682423 0.86 POLB (0.50) POLBMMP9GAAMAPTKMT2A
SCHEMBL5359166 0.82 MAPT (0.52) POLBMMP9GAAMAPTKMT2A
SCHEMBL13597571 0.80 POLB (0.76) POLBGAAMAPTKMT2AKDM4E
SCHEMBL12384188 0.80 POLB (0.76) POLBGAAMAPTKMT2AKDM4E
SCHEMBL14608274 0.80 POLB (0.76) POLBGAAMAPTKMT2AKDM4E
SCHEMBL3408946 0.80 POLB (1.00) POLBGAAMAPTKMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0614542-B1 ARYLIDENE SENSITIZING DYES FOR TABULAR GRAINS STERLING DIAGNOSTIC IMAGING (US) 2000-01-19 EP disclosed
EP-0614542-A1 ARYLIDENE SENSITIZING DYES FOR TABULAR GRAINS Sterling Diagnostic Imaging, Inc. (US) 1994-09-14 EP disclosed
US-5275928-A Photographic element; hydrophilic colloid layer E. I. DU PONT DE NEMOURS AND COMPANY (US) 1994-01-04 US disclosed
WO-1993011458-A1 ARYLIDENE SENSITIZING DYES FOR TABULAR GRAINS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1993-06-10 WO disclosed