SCHEMBL537032

SCHEMBL537032

CC(C)Oc1ccc(S(=O)(=O)c2ccc(OCCOc3ccc(S(=O)(=O)c4ccc(O)cc4)cc3)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.54
PKM P14618 2/20 0.54
ELANE P08246 2/20 0.48
ALDH1A1 P00352 3/20 0.45
NPSR1 Q6W5P4 1/20 0.43
KMT2A Q03164 2/20 0.43
LMNA P02545 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
LTA4H P09960 3/20 0.42
NR5A1 Q13285 1/20 0.42
KDM4E B2RXH2 1/20 0.42
NAMPT P43490 1/20 0.41
MMP3 P08254 2/20 0.41
CTRC Q99895 1/20 0.41
MMP2 P08253 1/20 0.41
MMP9 P14780 1/20 0.41
MMP14 P50281 1/20 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
SCHEMBL536828 0.95 GAA (0.53) GAAPKMELANEALDH1A1NPSR1
SCHEMBL536872 0.95 GAA (0.53) GAAPKMELANEALDH1A1NPSR1
SCHEMBL536962 0.94 GAA (0.51) GAAPKMELANEALDH1A1NPSR1
SCHEMBL537247 0.94 GAA (0.51) GAAPKMELANEALDH1A1NPSR1
SCHEMBL536903 0.94 GAA (0.51) GAAPKMELANEALDH1A1NPSR1
SCHEMBL537261 0.94 GAA (0.51) GAAPKMELANEALDH1A1NPSR1
SCHEMBL30485903 0.92 GAA (0.49) GAAPKMELANEALDH1A1NPSR1
SCHEMBL26268 0.91 PKM (0.65) GAAPKMELANEKMT2ANAMPT
SCHEMBL10187798 0.88 NAMPT (0.48) GAAPKMELANEALDH1A1NPSR1
SCHEMBL1793890 0.87 PKM (0.63) GAAPKMELANEALDH1A1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2181853-B1 Thermosensitive recording medium JUJO PAPER CO LTD (JP) 2015-09-23 EP disclosed
US-8722576-B2 Thermosensitive recording label NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2014-05-13 US disclosed
EP-2415614-B1 COATING SOLUTION FOR HEAT-SENSITIVE COLOR-DEVELOPING LAYER, AND HEAT-SENSITIVE RECORDING MATERIAL JUJO PAPER CO LTD (JP) 2014-01-22 EP disclosed
EP-2474963-B1 THERMOSENSITIVE RECORDING LABEL JUJO PAPER CO LTD (JP) 2013-11-13 EP disclosed
US-8470735-B2 Coating solution for heat-sensitive color-developing layer, and heat-sensitive recording material NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2013-06-25 US disclosed
US-20120208698-A1 THERMOSENSITIVE RECORDING LABEL NIPPON PAPER INDUSTRIES CO., LTD 2012-08-16 US disclosed
US-20120157303-A1 COATING SOLUTION FOR HEAT-SENSITIVE COLOR-DEVELOPING LAYER, AND HEAT-SENSITIVE RECORDING MATERIAL API CORPORATION (JP) 2012-06-21 US disclosed
EP-2415614-A1 COATING SOLUTION FOR HEAT-SENSITIVE COLOR-DEVELOPING LAYER, AND HEAT-SENSITIVE RECORDING MATERIAL Nippon Paper Industries Co., Ltd. (JP) 2012-02-08 EP disclosed