SCHEMBL5484677

SCHEMBL5484677

CCCCCCCC(COC(=O)O)OCCOCC

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
LMNA P02545 1/20 0.39
LPAR1 Q92633 2/20 0.38
LPAR3 Q9UBY5 2/20 0.38
TLR2 O60603 4/20 0.38
GPR84 Q9NQS5 3/20 0.38
FFAR1 O14842 1/20 0.38
ZDHHC7 Q9NXF8 1/20 0.37
MAPT P10636 1/20 0.37
LCK P06239 1/20 0.37
PPARD Q03181 1/20 0.37
ZDHHC20 Q5W0Z9 1/20 0.37
ZDHHC2 Q9UIJ5 1/20 0.37
HCAR2 Q8TDS4 1/20 0.36
PRKCA P17252 1/20 0.36
PRKCE Q02156 1/20 0.36
PRKCQ Q04759 1/20 0.36
PRKCD Q05655 1/20 0.36
TSHR P16473 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
SCHEMBL5480815 1.00 ALDH1A1 (0.39) ALDH1A1LMNALPAR1LPAR3TLR2
SCHEMBL5483734 0.91 LPAR1 (0.41) ALDH1A1LMNALPAR1LPAR3TLR2
SCHEMBL5484671 0.90 ALDH1A1 (0.40) ALDH1A1LMNALPAR1LPAR3TLR2
SCHEMBL5480812 0.90 ALDH1A1 (0.40) ALDH1A1LMNALPAR1LPAR3TLR2
SCHEMBL5480827 0.88 HCAR2 (0.40) ALDH1A1LPAR1LPAR3TLR2GPR84
SCHEMBL11297776 0.88 LPAR1 (0.45) ALDH1A1LMNALPAR1LPAR3TLR2
SCHEMBL5480624 0.87 ZDHHC7 (0.41) ALDH1A1LMNALPAR1LPAR3GPR84
SCHEMBL5484202 0.87 ZDHHC7 (0.41) ALDH1A1LMNALPAR1LPAR3GPR84
SCHEMBL7141660 0.83 ALDH1A1 (0.38) ALDH1A1LMNALPAR1LPAR3TLR2
SCHEMBL5484206 0.82 ALDH1A1 (0.38) ALDH1A1HCAR2PRKCAPRKCDTSHR

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-1744394-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2007-01-17 EP disclosed