SCHEMBL3428025

SCHEMBL3428025

O=S(=O)(O)CNN=Nc1ccc(S(=O)(=O)O)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.53
CYP2D6 P10635 1/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
RPS6KA3 P51812 1/20 0.42
LMNA P02545 1/20 0.39
PHLPP2 Q6ZVD8 2/20 0.39
TSHR P16473 2/20 0.38
ALDH1A1 P00352 1/20 0.38
NT5E P21589 1/20 0.38
ATIC P31939 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
GLO1 Q04760 1/20 0.36
SUMO2 P61956 1/20 0.36
SUMO1 P63165 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP2 Q9HC62 1/20 0.36
CA12 O43570 4/20 0.36
CA2 P00918 4/20 0.36
CA9 Q16790 4/20 0.36

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
SCHEMBL3424198 0.82 POLB (0.47) POLBCYP2D6MEN1KMT2ALMNA
SCHEMBL13252238 0.82 POLB (0.47) POLBCYP2D6MEN1KMT2ALMNA
SCHEMBL3425860 0.81 POLB (0.51) POLBCYP2D6MEN1KMT2ARPS6KA3
SCHEMBL3425304 0.81 MEN1 (0.50) POLBMEN1KMT2ALMNAALDH1A1
SCHEMBL3423709 0.80 POLB (0.54) POLBCYP2D6MEN1KMT2ARPS6KA3
SCHEMBL11331831 0.78 POLB (0.60) POLBCYP2D6MEN1KMT2ARPS6KA3
SCHEMBL3425849 0.78 POLB (0.51) POLBCYP2D6MEN1KMT2ARPS6KA3
SCHEMBL11331835 0.78 POLB (0.60) POLBCYP2D6MEN1KMT2ARPS6KA3
SCHEMBL18624977 0.77 POLB (0.83) POLBCYP2D6MEN1KMT2ARPS6KA3
SCHEMBL28560987 0.77 POLB (0.83) POLBCYP2D6MEN1KMT2ARPS6KA3

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