SCHEMBL27433717

SCHEMBL27433717

O=S(=O)(O)CCS(=O)(=O)OS(=O)(=O)CCS(=O)(=O)OS(=O)(=O)CCS(=O)(=O)O

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.43
PDE4A P27815 1/20 0.43
LMNA P02545 1/20 0.43
SLC6A6 P31641 1/20 0.43
CYP2C19 P33261 1/20 0.43
BLM P54132 1/20 0.43
APP P05067 1/20 0.39
CA2 P00918 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
SCHEMBL575979 1.00 PTGS1 (0.43) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL2701823 0.89 APP (0.44) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL28085546 0.89 LMNA (0.36) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL9526347 0.84 PTGS1 (0.36) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL576543 0.82 APP (0.48) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL576422 0.82 APP (0.48) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL21777928 0.79 PTGS1 (0.60) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL2622 0.79 PTGS1 (0.60) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL499923 0.79 PTGS1 (0.41) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL3219118 0.77 LMNA (0.46) PTGS1PDE4ALMNASLC6A6CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101278888-B Oral care compositions and methods COLGATE PALMOLIVE CO 2015-04-08 CN disclosed
CN-1756524-B Oral care compositions and methods COLGATE PALMOLIVE CO 2013-11-06 CN disclosed
CN-102895127-A Oral care compositions and methods COLGATE PALMOLIVE CO 2013-01-30 CN disclosed
CN-101278888-A Oral care compositions and methods COLGATE PALMOLIVE CO (US) 2008-10-08 CN disclosed
CN-1756524-A Oral care compositions and methods COLGATE PALMOLIVE CO (US) 2006-04-05 CN disclosed
CN-1128947-A Soft-shelled gelatin encapsulated particles SMITHKLINE BEECHAM CORP (US) 1996-08-14 CN disclosed