SCHEMBL4759937

SCHEMBL4759937

O=C(O)/C=C/C(O)CCCCCCO

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.49
BACE1 P56817 1/20 0.49
GPR84 Q9NQS5 1/20 0.41
FFAR1 O14842 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41
PTPN1 P18031 1/20 0.38
PPARG P37231 2/20 0.37
GPR132 Q9UNW8 1/20 0.37
TRPA1 O75762 1/20 0.36
DDAH1 O94760 1/20 0.36
GAPDH P04406 1/20 0.36
MAPT P10636 1/20 0.36
FAAH O00519 1/20 0.35
CAMK2A Q9UQM7 1/20 0.34
GABRP O00591 2/20 0.34
GABRD O14764 2/20 0.34
GABRA1 P14867 2/20 0.34
GABRB1 P18505 2/20 0.34
GABRG2 P18507 2/20 0.34
GABRB3 P28472 2/20 0.34

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
SCHEMBL4745520 1.00 ACHE (0.49) ACHEBACE1GPR84FFAR1FFAR4
SCHEMBL27963352 1.00 ACHE (0.49) ACHEBACE1GPR84FFAR1FFAR4
SCHEMBL561406 1.00 ACHE (0.49) ACHEBACE1GPR84FFAR1FFAR4
SCHEMBL15287182 1.00 ACHE (0.49) ACHEBACE1GPR84FFAR1FFAR4
SCHEMBL649787 1.00 ACHE (0.49) ACHEBACE1GPR84FFAR1FFAR4
SCHEMBL15286996 1.00 ACHE (0.49) ACHEBACE1GPR84FFAR1FFAR4
Adipic Acid SCHEMBL6760249 0.93 FFAR1 (0.55) ACHEBACE1GPR84FFAR1FFAR4
SCHEMBL2763308 0.92 ACHE (0.52) ACHEBACE1GPR84FFAR1FFAR4
SCHEMBL23647621 0.87 ACHE (0.67) ACHEBACE1PPARGGPR132TRPA1
SCHEMBL21049245 0.87 ACHE (0.67) ACHEBACE1PPARGGPR132TRPA1

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
JP-2008150348-A NEW COMPOUND YAMADA BEE FARM CORP 2008-07-03 JP disclosed