SCHEMBL16638883

SCHEMBL16638883

CCCSCCCS(=O)(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.41
CA2 P00918 1/20 0.36
EPHX2 P34913 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
BLM P54132 2/20 0.33
CES2 O00748 1/20 0.33
PTGS1 P23219 1/20 0.33
PDE4A P27815 1/20 0.33
GMNN O75496 1/20 0.33
TP53 P04637 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
THRB P10828 1/20 0.33
CYP2C9 P11712 1/20 0.33
HSD17B10 Q99714 1/20 0.33
LMNA P02545 1/20 0.33
SLC6A6 P31641 1/20 0.33
CYP2C19 P33261 1/20 0.33
CES1 P23141 1/20 0.31
TSHR P16473 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
SCHEMBL15297847 0.98 APP (0.39) APPCA2EPHX2TDP1BLM
SCHEMBL17853912 0.89 APP (0.33) APPCA2EPHX2
SCHEMBL517829 0.88 APP (0.50) APPBLMPTGS1PDE4ALMNA
SCHEMBL10060664 0.86 TDP1 (0.37) APPCA2EPHX2TDP1BLM
SCHEMBL518580 0.85 APP (0.48) APPBLMPTGS1PDE4ALMNA
SCHEMBL565134 0.85 APP (0.48) APPBLMPTGS1PDE4ALMNA
SCHEMBL15297851 0.85 APP (0.48) APPBLMPTGS1PDE4ALMNA
SCHEMBL15339864 0.85 APP (0.33) APPCA2EPHX2
SCHEMBL9883940 0.84 TSHR (0.46) APPCA2EPHX2BLMCES2
SCHEMBL564743 0.83 APP (0.46) APPBLMPTGS1PDE4ALMNA

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-2860215-A1 MODIFIED HYDROPHILIC ACRYLIC RESIN FILM Mitsui Chemicals, Inc. (JP) 2015-04-15 EP disclosed