SCHEMBL5187449

SCHEMBL5187449

CCCCC=C(CC(C)O)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 7/20 0.65
GRIK2 Q13002 3/20 0.50
EP300 Q09472 1/20 0.44
GPR84 Q9NQS5 7/20 0.35
F7 P08709 1/20 0.35
F3 P13726 1/20 0.35
GRIA2 P42262 2/20 0.33
GRIA4 P48058 2/20 0.33
GRIK3 Q13003 2/20 0.33
GRIK5 Q16478 2/20 0.33
GRIA1 P42261 1/20 0.33
FFAR1 O14842 1/20 0.33

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
Ether SCHEMBL28065387 0.92 GRIK1 (0.56) GRIK1GRIK2EP300GPR84F7
Fluoride SCHEMBL27740263 0.91 GRIK1 (0.55) GRIK1GRIK2EP300GPR84F7
SCHEMBL8764538 0.80 GRIK1 (0.58) GRIK1GRIK2EP300F7F3
SCHEMBL8764536 0.80 GRIK1 (0.58) GRIK1GRIK2EP300F7F3
SCHEMBL8399799 0.79 GRIK1 (1.00) GRIK1GRIK2EP300GRIA2GRIA4
SCHEMBL8724519 0.79 GRIK1 (1.00) GRIK1GRIK2EP300GRIA2GRIA4
SCHEMBL8724521 0.79 GRIK1 (1.00) GRIK1GRIK2EP300GRIA2GRIA4
SCHEMBL8399788 0.79 GRIK1 (1.00) GRIK1GRIK2EP300GRIA2GRIA4
SCHEMBL8724517 0.79 GRIK1 (1.00) GRIK1GRIK2EP300GRIA2GRIA4
SCHEMBL8399796 0.79 GRIK1 (1.00) GRIK1GRIK2EP300GRIA2GRIA4

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-1806603-A1 ANISOTROPIC DIFFUSION MEDIUM TOMOEGAWA PAPER CO. LTD. (JP) 2007-07-11 EP disclosed