SCHEMBL13656157

SCHEMBL13656157

COc1ccc(N=Nc2c(S(=O)(=O)O)cc3c(S(=O)(=O)O)c(N=Nc4c(S(=O)(=O)O)cc5ccc(N=Nc6ccc7c(O)c(N=Nc8ccccc8S(=O)(=O)O)c(SOOO)cc7c6)c(O)c5c4N)ccc3c2O)c(SOOO)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PHLPP2 Q6ZVD8 1/20 0.41
▸ ENPP2 Q13822 12/20 0.41
▸ PTPN11 Q06124 1/20 0.35
▸ CD40 P25942 1/20 0.35
▸ CD40LG P29965 1/20 0.35
▸ CYP1A2 P05177 1/20 0.34
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ APEX1 P27695 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ BRCA1 P38398 1/20 0.33
▸ RECQL P46063 1/20 0.33

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
SCHEMBL14507134 0.96 PHLPP2 (0.39) PHLPP2ENPP2PTPN11CD40CD40LG
SCHEMBL1108411 0.96 ENPP2 (0.45) PHLPP2ENPP2PTPN11CD40CD40LG
SCHEMBL12052419 0.96 ENPP2 (0.45) PHLPP2ENPP2PTPN11CD40CD40LG
SCHEMBL13388581 0.91 ENPP2 (0.47) PHLPP2ENPP2PTPN11CD40CD40LG
SCHEMBL13656158 0.90 PHLPP2 (0.39) PHLPP2ENPP2PTPN11CD40CD40LG
SCHEMBL12878720 0.90 ENPP2 (0.40) PHLPP2ENPP2PTPN11CD40CD40LG
SCHEMBL14374888 0.90 PHLPP2 (0.42) PHLPP2ENPP2PTPN11CD40CD40LG
SCHEMBL14445776 0.90 ENPP2 (0.45) PHLPP2ENPP2PTPN11CD40CD40LG
SCHEMBL13994860 0.90 ENPP2 (0.45) PHLPP2ENPP2PTPN11CD40CD40LG
SCHEMBL13994880 0.89 PHLPP2 (0.40) PHLPP2ENPP2PTPN11CD40CD40LG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7604335-B2 Ink cartridge CANON KABUSHIKI KAISHA (JP) 2009-10-20 — — US disclosed
US-7594719-B2 Mailing ink, and ink tank for mailing, ink jet recording method for mailing and ink jet recording apparatus for mailing using the same CANON KABUSHIKI KAISHA (JP) 2009-09-29 — — US disclosed
US-7578585-B2 Thermal ink-jet ink and ink cartridge using the ink CANON KABUSHIKI KAISHA (JP) 2009-08-25 — — US disclosed
US-20070148376-A1 MAILING INK, AND INK TANK FOR MAILING, INK JET RECORDING METHOD FOR MAILING AND INK JET RECORDING APPARATUS FOR MAILING USING THE SAME CANON KABUSHIKI KAISHA (JP) 2007-06-28 — — US disclosed
US-20070109390-A1 Thermal ink-jet ink and ink cartridge using the ink CANON KABUSHIKI KAISHA (JP) 2007-05-17 — — US disclosed
US-7198665-B2 Ink jet black ink, ink set, ink jet recording method, ink cartridge, recording unit and ink jet recording apparatus CANON KABUSHIKI KAISHA (JP) 2007-04-03 — — US disclosed
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