SCHEMBL13763490

SCHEMBL13763490

Cc1ccc(S(=O)(=O)O)c(N=Nc2c(S(=O)(=O)O)cc3cc(S(=O)(=O)O)c(N=Nc4ccc(S(=O)(=O)O)cc4)c(N)c3c2O)c1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 8/20 0.54
▸ MEN1 O00255 1/20 0.52
▸ HTT P42858 1/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ CYP1A2 P05177 3/20 0.50
▸ THRB P10828 1/20 0.50
▸ PRMT1 Q99873 1/20 0.48
▸ PHLPP2 Q6ZVD8 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ HIF1A Q16665 1/20 0.48
▸ CYP2C9 P11712 2/20 0.47
▸ SUMO2 P61956 1/20 0.47
▸ SUMO1 P63165 1/20 0.47
▸ SENP7 Q9BQF6 1/20 0.47
▸ SENP2 Q9HC62 1/20 0.47
▸ CD40 P25942 1/20 0.45
▸ CD40LG P29965 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ DNASE1L3 Q13609 1/20 0.45

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
SCHEMBL18218261 0.94 PRMT1 (0.56) ENPP2MEN1HTTKMT2ACYP1A2
SCHEMBL16062682 0.92 PRMT1 (0.58) ENPP2MEN1HTTKMT2ACYP1A2
SCHEMBL13763489 0.91 ENPP2 (0.51) ENPP2MEN1HTTKMT2ACYP1A2
SCHEMBL10392756 0.90 ENPP2 (0.56) ENPP2MEN1HTTKMT2ACYP1A2
SCHEMBL8070745 0.90 ENPP2 (0.56) ENPP2MEN1HTTKMT2ACYP1A2
SCHEMBL18218263 0.89 ENPP2 (0.51) ENPP2MEN1HTTKMT2ACYP1A2
SCHEMBL17676441 0.87 ENPP2 (0.58) ENPP2MEN1HTTKMT2ACYP1A2
SCHEMBL10706139 0.85 ENPP2 (0.58) ENPP2MEN1HTTKMT2ACYP1A2
SCHEMBL10393301 0.83 ENPP2 (0.58) ENPP2MEN1HTTKMT2ACYP1A2
SCHEMBL10393912 0.83 ENPP2 (0.58) ENPP2MEN1HTTKMT2ACYP1A2

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 3 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
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