SCHEMBL17599277

SCHEMBL17599277

OB(O)C1(B(O)O)C=CC(C=Cc2ccccc2)=CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.38
TTR P02766 1/20 0.34
ALOX5 P09917 1/20 0.34
PTGS1 P23219 1/20 0.34
PTGS2 P35354 1/20 0.34
TRPA1 O75762 1/20 0.33
CHAT P28329 1/20 0.33
CHRNB4 P30926 5/20 0.32
CHRNA3 P32297 5/20 0.32
CHRNA7 P36544 5/20 0.32
CHRNB2 P17787 4/20 0.32
CHRNA4 P43681 4/20 0.32
CHRNA10 Q9GZZ6 4/20 0.32
CHRNA9 Q9UGM1 4/20 0.32
MAOB P27338 2/20 0.32
NFE2L2 Q16236 1/20 0.32
CYP19A1 P11511 1/20 0.32
MAOA P21397 1/20 0.32
PTPN1 P18031 1/20 0.31
HNF4A P41235 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
SCHEMBL5189265 0.81 CHAT (0.34) TTRALOX5PTGS1PTGS2TRPA1
SCHEMBL2532692 0.79 TTR (0.37) CA1TTRALOX5PTGS1PTGS2
SCHEMBL27693757 0.78 MAOB (0.37) TTRALOX5PTGS1PTGS2TRPA1
SCHEMBL4438933 0.77 MAOB (0.39) TTRALOX5PTGS1PTGS2TRPA1
SCHEMBL7324466 0.76 TRPA1 (0.37) CA1TTRALOX5PTGS1PTGS2
SCHEMBL6837817 0.76 CHAT (0.35) TTRALOX5PTGS1PTGS2TRPA1
SCHEMBL28484538 0.76 CHAT (0.39) TTRALOX5PTGS1PTGS2TRPA1
Hydrochloric Acid SCHEMBL12003783 0.76 MAOB (0.38) TTRALOX5PTGS1PTGS2TRPA1
SCHEMBL30781477 0.76 CHAT (0.39) TTRALOX5PTGS1PTGS2TRPA1
SCHEMBL31506486 0.76 CHAT (0.35) TTRALOX5PTGS1PTGS2TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3419987-A1 AFFINITY LIGAND FOR THE PURIFICATION OF GLYCOSYLATED BIOMOLECULES Hochschule für Technik und Wirtschaft (HTW) Berlin (DE) 2019-01-02 EP claimed
WO-2017144099-A1 AFFINITY LIGAND FOR THE PURIFICATION OF GLYCOSYLATED BIOMOLECULES HOCHSCHULE FÜR TECHNIK UND WIRTSCHAFT (HTW) BERLIN (DE) 2017-08-31 WO claimed
EP-3419987-A1 AFFINITY LIGAND FOR THE PURIFICATION OF GLYCOSYLATED BIOMOLECULES Hochschule für Technik und Wirtschaft (HTW) Berlin (DE) 2019-01-02 EP disclosed
EP-2998008-B1 Product protective capture and elution of N-glycosylated therapeutic glycoproteins and enveloped viruses HOCHSCHULE FÜR TECHNIK UND WIRTSCH (HTW) BERLIN (DE) 2018-02-07 EP disclosed
WO-2017144099-A1 AFFINITY LIGAND FOR THE PURIFICATION OF GLYCOSYLATED BIOMOLECULES HOCHSCHULE FÜR TECHNIK UND WIRTSCHAFT (HTW) BERLIN (DE) 2017-08-31 WO disclosed
WO-2016041844-A1 PRODUCT PROTECTIVE CAPTURE AND ELUTION OF N-GLYCOSYLATED THERAPEUTIC GLYCOPROTEINS AND ENVELOPED VIRUSES HOCHSCHULE FÜR TECHNIK UND WIRTSCHAFT (HTW) BERLIN (DE) 2016-03-24 WO disclosed
EP-2998008-A1 Product protective capture and elution of N-glycosylated therapeutic glycoproteins and enveloped viruses Hochschule für Technik und Wirtschaft Berlin (DE) 2016-03-23 EP disclosed