SCHEMBL22256406

SCHEMBL22256406

COc1cc(S(=O)(=O)CCOS(=O)(=O)O)c(C)cc1N=Nc1ccc(N=Nc2c(O)cc(C(=O)O)c(N=Nc3ccc(S(=O)(=O)CCOS(=O)(=O)O)cc3)c2O)cc1NC(N)=O

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PHLPP2 Q6ZVD8 5/20 0.42
▸ PTPN1 P18031 2/20 0.37
▸ THRB P10828 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ ENPP2 Q13822 5/20 0.34
▸ GLO1 Q04760 1/20 0.33
▸ PTGS1 P23219 2/20 0.32
▸ PTGS2 P35354 2/20 0.32
▸ BRD4 O60885 1/20 0.32
▸ CA2 P00918 1/20 0.31
▸ CA3 P07451 1/20 0.31

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
SCHEMBL22256271 0.97 PHLPP2 (0.40) PHLPP2PTPN1THRBMEN1GAA
SCHEMBL22256363 0.95 PHLPP2 (0.41) PHLPP2PTPN1THRBMEN1GAA
SCHEMBL22256273 0.94 PHLPP2 (0.43) PHLPP2PTPN1THRBMEN1GAA
SCHEMBL22256307 0.94 PHLPP2 (0.43) PHLPP2PTPN1THRBMEN1GAA
SCHEMBL22256358 0.92 PHLPP2 (0.40) PHLPP2PTPN1MEN1GAAMAPT
SCHEMBL22256315 0.92 PHLPP2 (0.40) PHLPP2PTPN1MEN1GAAMAPT
SCHEMBL22256268 0.92 PHLPP2 (0.47) PHLPP2THRBMEN1GAAMAPT
SCHEMBL22411986 0.91 PHLPP2 (0.46) PHLPP2PTPN1THRBMEN1GAA
SCHEMBL22256326 0.89 THRB (0.40) PHLPP2THRBMEN1GAAMAPT
SCHEMBL22256355 0.89 THRB (0.40) PHLPP2THRBMEN1GAAMAPT

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-11370921-B2 Reactive dye compound and preparation method and application thereof Shanghai Kehua dyestuff Industry Co., Ltd. (CN) 2022-06-28 — — US disclosed
US-20200231819-A1 A REACTIVE DYE COMPOUND AND PREPARATION METHOD AND APPLICATION THEREOF ZHEJIANG KEYONG CHEMICAL CO., LTD. (CN) 2020-07-23 — — US disclosed
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