SCHEMBL14022705

SCHEMBL14022705

COc1ccc(N=Nc2ccc(N=Nc3cccc(S(=O)(=O)O)c3)cc2OC)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PHLPP2 Q6ZVD8 1/20 0.57
SENP3 Q9H4L4 2/20 0.50
SENP2 Q9HC62 2/20 0.50
SENP1 Q9P0U3 2/20 0.50
SUMO2 P61956 1/20 0.50
SUMO1 P63165 1/20 0.50
SENP7 Q9BQF6 1/20 0.50
KMT2A Q03164 5/20 0.46
MEN1 O00255 4/20 0.46
POLB P06746 3/20 0.46
MAPT P10636 3/20 0.46
MAPK1 P28482 3/20 0.46
GAA P10253 2/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
ALOX12 P18054 1/20 0.46
CYP2C19 P33261 1/20 0.46

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
SCHEMBL9017465 0.93 SENP3 (0.52) PHLPP2SENP3SENP2SENP1SUMO2
SCHEMBL9017464 0.93 SENP3 (0.52) PHLPP2SENP3SENP2SENP1SUMO2
SCHEMBL3304735 0.90 PTGS2 (0.54) PHLPP2SENP3SENP2SENP1SUMO2
SCHEMBL3304737 0.90 PTGS2 (0.54) PHLPP2SENP3SENP2SENP1SUMO2
SCHEMBL29417405 0.88 PHLPP2 (0.49) PHLPP2KMT2AMEN1POLBMAPT
SCHEMBL13679650 0.85 PHLPP2 (0.52) PHLPP2SENP3SENP2SENP1SUMO2
SCHEMBL5705390 0.84 SENP2 (0.57) PHLPP2SENP3SENP2SENP1SUMO2
SCHEMBL3309129 0.83 PHLPP2 (0.63) PHLPP2KMT2AMEN1POLBMAPT
SCHEMBL3309127 0.83 PHLPP2 (0.63) PHLPP2KMT2AMEN1POLBMAPT
SCHEMBL13358862 0.81 PTGS2 (0.47) PHLPP2SENP3SENP2SENP1SUMO2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080280052-A1 Process for Printing Textile Fibre Materials in Accordance with the Ink-Jet Printing Process HUNTSMAN INTERNATIONAL LLC 2008-11-13 US disclosed
US-20070226919-A1 Method for Dyeing or Printing Textile Materials HUNTSMAN INTERNATIONAL LLC (US) 2007-10-04 US disclosed