SCHEMBL7108501

SCHEMBL7108501

CCCCCC(CC(=O)C(CC)C(=O)O)O[Si](C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.39
FFAR1 O14842 2/20 0.39
MAPT P10636 1/20 0.38
LCK P06239 1/20 0.38
PPARD Q03181 1/20 0.38
ZDHHC20 Q5W0Z9 1/20 0.38
ZDHHC2 Q9UIJ5 1/20 0.38
CA2 P00918 1/20 0.36
MAPK1 P28482 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36
ACE2 Q9BYF1 1/20 0.36
GRIK1 P39086 2/20 0.34
GRIK2 Q13002 2/20 0.34
SLC1A2 P43004 1/20 0.34
SLC1A1 P43005 1/20 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
SCHEMBL7101825 0.91 GPR84 (0.42) GPR84FFAR1MAPTLCKPPARD
SCHEMBL7101909 0.81 ZDHHC7 (0.45) GPR84FFAR1CA2FFAR4
SCHEMBL27574737 0.81 ZDHHC7 (0.45) GPR84FFAR1CA2FFAR4
SCHEMBL27552552 0.81 ZDHHC7 (0.36) GPR84FFAR1MAPTFFAR4
SCHEMBL7106845 0.81 ZDHHC7 (0.36) GPR84FFAR1MAPTFFAR4
SCHEMBL7103007 0.81 GPR84 (0.53) GPR84FFAR1MAPTLCKPPARD
SCHEMBL7103003 0.81 GPR84 (0.53) GPR84FFAR1MAPTLCKPPARD
SCHEMBL28072157 0.79 GPR84 (0.38) GPR84FFAR1MAPTLCKPPARD
SCHEMBL7104806 0.77 GPR84 (0.41) GPR84FFAR1MAPTLCKPPARD
SCHEMBL7103210 0.76 ALDH1A1 (0.41) GPR84FFAR1MAPTLCKPPARD

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-1127886-B1 Synthesis of 3,6-dialkyl-5,6-dihydro-4-hydroxy-2H-pyran-2one HOFFMANN LA ROCHE (CH) 2003-05-07 EP claimed