SCHEMBL5616787

SCHEMBL5616787

CCC(C)(C)C(=O)Oc1cc(OC(=O)C(C)(C)CC)cc(C2C(=O)Oc3c2cc(C(C)(C)C)cc3C(C)(C)C)c1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GABBR2 O75899 1/20 0.34
GABBR1 Q9UBS5 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
SCHEMBL5646348 0.80 GABBR2 (0.37) GABBR2GABBR1
SCHEMBL5083413 0.78 GABBR2 (0.43) GABBR2GABBR1
SCHEMBL39328 0.78 GABBR2 (0.39) GABBR2GABBR1
SCHEMBL29104599 0.76 CUL4A (0.39) GABBR2GABBR1
Butane SCHEMBL28053792 0.75 GABBR2 (0.37) GABBR2GABBR1
SCHEMBL29413920 0.75 GABBR2 (0.36) GABBR2GABBR1
SCHEMBL39102 0.75 GABBR2 (0.36) GABBR2GABBR1
SCHEMBL29478047 0.75 GABBR2 (0.41) GABBR2GABBR1
SCHEMBL30132965 0.75 GABBR2 (0.41) GABBR2GABBR1
SCHEMBL493693 0.75 GABBR2 (0.41) GABBR2GABBR1

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
US-20070072979-A1 Dispersing agents in nanocomposites POLYMERS AUSTRALIA PTY, LIMITED (AU) 2007-03-29 US disclosed