SCHEMBL13763561

SCHEMBL13763561

COc1ccc(N=Nc2c(S(=O)(=O)O)cc3c(S(=O)(=O)O)c(C)ccc3c2O)c(S(=O)(=O)O)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PHLPP2 Q6ZVD8 2/20 0.42
▸ ENPP2 Q13822 8/20 0.42
▸ MPL P40238 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.40
▸ HIF1A Q16665 1/20 0.40
▸ CD40 P25942 1/20 0.40
▸ CD40LG P29965 1/20 0.40
▸ MEN1 O00255 4/20 0.38
▸ KMT2A Q03164 4/20 0.38
▸ HTT P42858 1/20 0.38
▸ MAPT P10636 3/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ TP53 P04637 2/20 0.37
▸ CYP3A4 P08684 2/20 0.37
▸ THRB P10828 2/20 0.37
▸ HPGD P15428 2/20 0.37
▸ ALOX15 P16050 2/20 0.37
▸ MAPK1 P28482 2/20 0.37
▸ BRCA1 P38398 2/20 0.37
▸ RECQL P46063 2/20 0.37

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
SCHEMBL13997351 0.88 PHLPP2 (0.46) PHLPP2ENPP2MPLALDH1A1CD40
SCHEMBL13994971 0.86 PHLPP2 (0.40) PHLPP2ENPP2MPLALDH1A1HIF1A
SCHEMBL14327516 0.83 PHLPP2 (0.38) PHLPP2ENPP2MPLALDH1A1HIF1A
SCHEMBL14400958 0.83 PHLPP2 (0.46) PHLPP2ENPP2MPLALDH1A1HIF1A
SCHEMBL1176837 0.83 ENPP2 (0.49) PHLPP2ENPP2MPLALDH1A1CD40
SCHEMBL13763509 0.82 CD40 (0.60) PHLPP2ENPP2ALDH1A1HIF1ACD40
SCHEMBL16605633 0.82 ALDH1A1 (0.53) PHLPP2ENPP2MPLALDH1A1HIF1A
SCHEMBL13763553 0.82 ALDH1A1 (0.53) PHLPP2ENPP2MPLALDH1A1HIF1A
SCHEMBL13741254 0.80 ENPP2 (0.53) PHLPP2ENPP2ALDH1A1CD40CD40LG
SCHEMBL13744722 0.79 MPL (0.40) PHLPP2ENPP2MPLALDH1A1HIF1A

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-20160326384-A1 HIGH FIXATION INK COMPOSITION FOR DIGITAL TEXTILE PRINTING EVERLIGHT CHEMICAL INDUSTRIAL CORPORATION (TW) 2016-11-10 — — US disclosed
EP-3091056-A1 HIGH FIXATION INK COMPOSITION FOR DIGITAL TEXTILE PRINTING Everlight Chemical Industrial Corporation (TW) 2016-11-09 — — EP disclosed
EP-2080833-A2 Method of printing cellulosic fibre materials without an additional fixing process step Huntsman Advanced Materials (Switzerland) GmbH (CH) 2009-07-22 — — EP disclosed
EP-1602695-B1 WATER-BASE BLACK INK COMPOSITION AND COLORED MATERIAL NIPPON KAYAKU KK (JP) 2008-04-23 — — EP disclosed
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