SCHEMBL22256356

SCHEMBL22256356

COc1cc(S(=O)(=O)CCOS(=O)(=O)O)c(C)cc1N=Nc1c(C(=O)O)cc(O)c(N=Nc2ccc(N=Nc3ccc(S(=O)(=O)CCOS(=O)(=O)O)cc3S(=O)(=O)O)c(NC(C)=O)c2)c1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PHLPP2 Q6ZVD8 3/20 0.41
▸ ENPP2 Q13822 6/20 0.36
▸ PTPN1 P18031 2/20 0.36
▸ CA2 P00918 1/20 0.34
▸ CA3 P07451 1/20 0.34
▸ MAPT P10636 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ CD40 P25942 1/20 0.32
▸ CD40LG P29965 1/20 0.32
▸ PRMT1 Q99873 1/20 0.32
▸ THRB P10828 1/20 0.31
▸ P2RX5 Q93086 1/20 0.31
▸ P2RX4 Q99571 1/20 0.31
▸ P2RX2 Q9UBL9 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ HTT P42858 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
SCHEMBL22256258 1.00 PHLPP2 (0.41) PHLPP2ENPP2PTPN1CA2CA3
SCHEMBL22256273 0.95 PHLPP2 (0.43) PHLPP2ENPP2PTPN1CA2CA3
SCHEMBL22256307 0.95 PHLPP2 (0.43) PHLPP2ENPP2PTPN1CA2CA3
SCHEMBL22256363 0.94 PHLPP2 (0.41) PHLPP2ENPP2PTPN1MAPTMEN1
SCHEMBL22256358 0.94 PHLPP2 (0.40) PHLPP2ENPP2PTPN1CA2CA3
SCHEMBL22256315 0.94 PHLPP2 (0.40) PHLPP2ENPP2PTPN1CA2CA3
SCHEMBL22256267 0.93 PHLPP2 (0.41) PHLPP2ENPP2CA2CA3MAPT
SCHEMBL22256417 0.91 PHLPP2 (0.41) PHLPP2ENPP2CA2CA3MAPT
SCHEMBL22413434 0.91 PHLPP2 (0.42) PHLPP2ENPP2PTPN1MAPTMEN1
SCHEMBL22256357 0.91 PHLPP2 (0.42) PHLPP2ENPP2CA2CA3MAPT

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-11370921-B2 Reactive dye compound and preparation method and application thereof Shanghai Kehua dyestuff Industry Co., Ltd. (CN) 2022-06-28 — — US disclosed
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
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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