SCHEMBL7098796

SCHEMBL7098796

CCOC(C)OOC(=O)/C=C/C(=O)OOC(C)OCC

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
HCAR2 Q8TDS4 4/20 0.38
ATM Q13315 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
KEAP1 Q14145 1/20 0.32
NFE2L2 Q16236 1/20 0.32
BCHE P06276 1/20 0.32
ACHE P22303 1/20 0.32
PTGS2 P35354 1/20 0.32

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
SCHEMBL7096988 1.00 LMNA (0.44) LMNAHCAR2ATMNPSR1KEAP1
SCHEMBL7096991 1.00 LMNA (0.44) LMNAHCAR2ATMNPSR1KEAP1
SCHEMBL27598884 0.93 HCAR2 (0.50) LMNAHCAR2
SCHEMBL27581369 0.93 HCAR2 (0.50) LMNAHCAR2
SCHEMBL27660129 0.90 LMNA (0.39) LMNAHCAR2
SCHEMBL131246 0.84 TSHR (0.42) LMNA
SCHEMBL2897717 0.78 LMNA (0.48) LMNAHCAR2ATMNPSR1KEAP1
SCHEMBL2898080 0.78 LMNA (0.48) LMNAHCAR2ATMNPSR1KEAP1
SCHEMBL9062711 0.78 LMNA (0.48) LMNA
SCHEMBL15512144 0.77 LMNA (0.46) LMNA

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-1339127-A1 SOLID POLYMER ELECTROLYTE AND CELL CONTAINING THE ELECTROLYTE DAINIPPON INK AND CHEMICALS, INC. (JP) 2003-08-27 EP disclosed