SCHEMBL14856462

SCHEMBL14856462

O=S(=O)(O)CCCSCCO

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.48
APP P05067 1/20 0.42
PTGS1 P23219 1/20 0.35
PDE4A P27815 1/20 0.35
LMNA P02545 1/20 0.35
SLC6A6 P31641 1/20 0.35
CYP2C19 P33261 1/20 0.35
BLM P54132 1/20 0.35

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
SCHEMBL4662177 0.98 TDP1 (0.46) TDP1APPPTGS1PDE4ALMNA
SCHEMBL517829 0.90 APP (0.50) APPPTGS1PDE4ALMNASLC6A6
SCHEMBL518580 0.87 APP (0.48) APPPTGS1PDE4ALMNASLC6A6
SCHEMBL565134 0.87 APP (0.48) APPPTGS1PDE4ALMNASLC6A6
SCHEMBL15297851 0.87 APP (0.48) APPPTGS1PDE4ALMNASLC6A6
SCHEMBL6049116 0.85 TDP1 (0.53) TDP1APPPTGS1PDE4ALMNA
SCHEMBL28042194 0.85 APP (0.46) APPPTGS1PDE4ALMNASLC6A6
SCHEMBL564743 0.85 APP (0.46) APPPTGS1PDE4ALMNASLC6A6
SCHEMBL27175673 0.85 APP (0.46) APPPTGS1PDE4ALMNASLC6A6
SCHEMBL11756346 0.80 APP (0.46) 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-2004404-B1 COPPER ELECTROPLATING OF PRINTING CYLINDERS MACDERMID INC (US) 2013-04-17 EP claimed