SCHEMBL22411986

SCHEMBL22411986

COc1cc(S(=O)(=O)CCOS(=O)(=O)O)c(C)cc1N=Nc1c(O)cc(C(=O)O)c(N=Nc2ccc(S(=O)(=O)CCOS(=O)(=O)O)cc2)c1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PHLPP2 Q6ZVD8 6/20 0.46
▸ PTPN1 P18031 2/20 0.42
▸ THRB P10828 1/20 0.39
▸ MEN1 O00255 3/20 0.38
▸ MAPT P10636 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ GAA P10253 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ PTGS1 P23219 2/20 0.34
▸ PTGS2 P35354 2/20 0.34
▸ ENPP2 Q13822 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ POLB P06746 2/20 0.33
▸ PKM P14618 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ GLO1 Q04760 2/20 0.33
▸ PRMT1 Q99873 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
SCHEMBL22412251 0.93 PHLPP2 (0.44) PHLPP2PTPN1THRBMEN1MAPT
SCHEMBL23126471 0.93 PTPN1 (0.40) PHLPP2PTPN1THRBMEN1MAPT
SCHEMBL22256273 0.92 PHLPP2 (0.43) PHLPP2PTPN1THRBMEN1MAPT
SCHEMBL22256307 0.92 PHLPP2 (0.43) PHLPP2PTPN1THRBMEN1MAPT
SCHEMBL22413434 0.91 PHLPP2 (0.42) PHLPP2PTPN1THRBMEN1MAPT
SCHEMBL22256406 0.91 PHLPP2 (0.42) PHLPP2PTPN1THRBMEN1MAPT
SCHEMBL22413433 0.90 PTPN1 (0.38) PHLPP2PTPN1THRBMEN1MAPT
SCHEMBL22413442 0.90 PHLPP2 (0.42) PHLPP2PTPN1MEN1MAPTKMT2A
SCHEMBL22256315 0.89 PHLPP2 (0.40) PHLPP2PTPN1MEN1MAPTKMT2A
SCHEMBL22256358 0.89 PHLPP2 (0.40) PHLPP2PTPN1MEN1MAPTKMT2A

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-10954392-B2 Reactive navy to black dye composition and dye product thereof ZHEJIANG KEYONG CHEMICAL CO., LTD. (CN) 2021-03-23 — — US disclosed
US-20200283634-A1 A REACTIVE NAVY TO BLACK DYE COMPOSITION AND DYE PRODUCT THEREOF Shanghai Kehua dyestuff Industry Co., Ltd. (CN) 2020-09-10 — — US disclosed
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