SCHEMBL22256361

SCHEMBL22256361

COc1ccc(S(=O)(=O)CCOS(=O)(=O)O)cc1N=Nc1c(O)cc(C(=O)O)c(N=Nc2ccc(N=Nc3ccc(S(=O)(=O)CCOS(=O)(=O)O)cc3S(=O)(=O)O)c(NCN=O)c2)c1O

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PHLPP2 Q6ZVD8 2/20 0.41
▸ PRMT1 Q99873 1/20 0.37
▸ MEN1 O00255 2/20 0.34
▸ MAPT P10636 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ GAA P10253 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ ENPP2 Q13822 3/20 0.32
▸ CD40 P25942 1/20 0.32
▸ CD40LG P29965 1/20 0.32
▸ MAPK1 P28482 1/20 0.31
▸ PTGS1 P23219 1/20 0.30

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
SCHEMBL22256365 0.92 PHLPP2 (0.40) PHLPP2MEN1MAPTKMT2ATDP1
SCHEMBL22256267 0.90 PHLPP2 (0.41) PHLPP2PRMT1MEN1MAPTKMT2A
SCHEMBL22256354 0.90 PHLPP2 (0.41) PHLPP2PRMT1MEN1MAPTKMT2A
SCHEMBL22256265 0.90 PHLPP2 (0.41) PHLPP2PRMT1MEN1MAPTKMT2A
SCHEMBL22256367 0.87 PHLPP2 (0.39) PHLPP2MEN1MAPTKMT2AGAA
SCHEMBL22412941 0.87 PHLPP2 (0.35) PHLPP2MEN1MAPTKMT2AGAA
SCHEMBL22256303 0.86 PHLPP2 (0.43) PHLPP2PRMT1MEN1MAPTKMT2A
SCHEMBL22256309 0.85 PHLPP2 (0.44) PHLPP2PRMT1MEN1MAPTKMT2A
SCHEMBL22256417 0.84 PHLPP2 (0.41) PHLPP2PRMT1MEN1MAPTKMT2A
SCHEMBL22413396 0.84 PHLPP2 (0.43) PHLPP2PRMT1MEN1MAPTKMT2A

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
Send feedback