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SCHEMBL2701823

SCHEMBL2701823

O=S(=O)(O)CCCS(=O)(=O)OS(=O)(=O)CCCS(=O)(=O)O.O=S(=O)(O)CCS(=O)(=O)OS(=O)(=O)CCS(=O)(=O)O

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 1/20 0.44
▸ PTGS1 P23219 1/20 0.36
▸ PDE4A P27815 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ SLC6A6 P31641 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ BLM P54132 1/20 0.36

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
SCHEMBL576422 0.95 APP (0.48) APPPTGS1PDE4ALMNASLC6A6
SCHEMBL576543 0.90 APP (0.48) APPPTGS1PDE4ALMNASLC6A6
SCHEMBL575979 0.89 PTGS1 (0.43) APPPTGS1PDE4ALMNASLC6A6
SCHEMBL27433717 0.89 PTGS1 (0.43) APPPTGS1PDE4ALMNASLC6A6
SCHEMBL28085546 0.80 LMNA (0.36) APPPTGS1PDE4ALMNASLC6A6
Eprodisate SCHEMBL34216 0.78 APP (0.65) APPPTGS1PDE4ALMNASLC6A6
SCHEMBL25630359 0.77 APP (0.46) APPPTGS1PDE4ALMNASLC6A6
SCHEMBL14975445 0.75 APP (0.44) APPPTGS1PDE4ALMNASLC6A6
SCHEMBL9526347 0.75 PTGS1 (0.36) APPPTGS1PDE4ALMNASLC6A6
SCHEMBL29104749 0.75 APP (0.44) APPPTGS1PDE4ALMNASLC6A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2450997-A1 Nonaqueous electrolyte for secondary battery and nonaqueous-electrolyte secondary battery employing the same Mitsubishi Chemical Corporation (JP) 2012-05-09 — — EP disclosed