SCHEMBL3428191

SCHEMBL3428191

O=[N+]([O-])c1ccc(N=NN(CS(=O)(=O)O)CS(=O)(=O)O)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.64
▸ ALDH1A1 P00352 5/20 0.64
▸ POLB P06746 2/20 0.64
▸ GAA P10253 2/20 0.64
▸ MEN1 O00255 6/20 0.48
▸ KMT2A Q03164 6/20 0.48
▸ RAB9A P51151 4/20 0.48
▸ MAPK1 P28482 3/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ NPC1 O15118 3/20 0.48
▸ TNNI3 P19429 1/20 0.48
▸ TNNT2 P45379 1/20 0.48
▸ TNNC1 P63316 1/20 0.48
▸ KEAP1 Q14145 1/20 0.48
▸ NFE2L2 Q16236 1/20 0.48
▸ PLAU P00749 1/20 0.42
▸ NOS1 P29475 2/20 0.41
▸ NPSR1 Q6W5P4 2/20 0.41
▸ TDP1 Q9NUW8 2/20 0.41
▸ HSP90AA1 P07900 2/20 0.41

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
SCHEMBL3422880 0.81 POLB (0.53) MAPTALDH1A1POLBGAAMEN1
SCHEMBL13252237 0.77 POLB (0.47) MAPTALDH1A1POLBGAAMEN1
SCHEMBL17088269 0.74 POLB (0.61) MAPTALDH1A1POLBGAAMEN1
SCHEMBL10973554 0.74 PLAU (0.50) MAPTALDH1A1POLBGAAMEN1
SCHEMBL3425304 0.73 MEN1 (0.50) MAPTALDH1A1POLBGAAMEN1
SCHEMBL3282773 0.72 MEN1 (0.61) MAPTALDH1A1POLBGAAMEN1
SCHEMBL3282776 0.72 MEN1 (0.61) MAPTALDH1A1POLBGAAMEN1
SCHEMBL27405564 0.72 MEN1 (0.66) MAPTALDH1A1POLBGAAMEN1
Sulfuric Acid SCHEMBL28654341 0.70 CA1 (0.62) ALDH1A1MAPK1TDP1LMNACA1
SCHEMBL17149472 0.69 PLAU (0.57) MAPTALDH1A1POLBGAAMEN1

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
US-7754273-B2 Method of printing a time-temperature indicator based on azo coupling reactions onto a susbtrate CIBA SPECIALTY CHEMICALS CORP. (US) 2010-07-13 — — US disclosed
US-20070218206-A1 Method of Printing a Time-Temperature Indicator Based on Azo Coupling Reactions onto a Susbtrate CIBA SPECIALTY CHEMICALS CORP. 2007-09-20 — — US disclosed
EP-1779104-A1 METHOD OF PRINTING A TIME-TEMPERATURE INDICATOR BASED ON AZO COUPLING REACTIONS ONTO A SUBSTRATE Ciba SC Holding AG (CH) 2007-05-02 — — EP disclosed
WO-2006015962-A1 METHOD OF PRINTING A TIME-TEMPERATURE INDICATOR BASED ON AZO COUPLING REACTIONS ONTO A SUBSTRATE CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2006-02-16 — — WO disclosed
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