SCHEMBL8612175

SCHEMBL8612175

CCCCCCC(OS(C)(=O)=O)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.48
FFAR1 O14842 2/20 0.48
MAPT P10636 1/20 0.47
LCK P06239 1/20 0.47
PPARD Q03181 1/20 0.47
ZDHHC20 Q5W0Z9 1/20 0.47
ZDHHC2 Q9UIJ5 1/20 0.47
ACE2 Q9BYF1 1/20 0.44
CTRC Q99895 1/20 0.42
CA2 P00918 1/20 0.42
GRIK1 P39086 1/20 0.41
GRIK2 Q13002 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41
CA1 P00915 1/20 0.40

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
SCHEMBL8863767 1.00 GPR84 (0.48) GPR84FFAR1MAPTLCKPPARD
SCHEMBL18704278 0.93 CA2 (0.44) GPR84FFAR1MAPTLCKPPARD
SCHEMBL2323492 0.93 CA2 (0.44) GPR84FFAR1MAPTLCKPPARD
SCHEMBL4813965 0.86 GPR84 (0.48) GPR84FFAR1MAPTLCKPPARD
SCHEMBL9301834 0.86 GPR84 (0.48) GPR84FFAR1MAPTLCKPPARD
SCHEMBL28758976 0.86 GPR84 (0.48) GPR84FFAR1MAPTLCKPPARD
SCHEMBL9294954 0.86 GPR84 (0.48) GPR84FFAR1MAPTLCKPPARD
SCHEMBL9294774 0.86 GPR84 (0.48) GPR84FFAR1MAPTLCKPPARD
SCHEMBL7274699 0.85 HDAC1 (0.43) GPR84FFAR1CA2GRIK1GRIK2
SCHEMBL9350162 0.85 HDAC1 (0.43) GPR84FFAR1CA2GRIK1GRIK2

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-0835251-A1 PROCESS FOR THE PRODUCTION OF LIPOIC ACID ASTA Medica Aktiengesellschaft (DE) 1998-04-15 EP disclosed