SCHEMBL12707641

SCHEMBL12707641

CCc1ccc(B(O)O)c(C)c1C

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 4/20 0.37
LPL P06858 3/20 0.37
GABRA1 P14867 2/20 0.34
GABRB2 P47870 2/20 0.34
CA2 P00918 1/20 0.31

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
SCHEMBL29951248 0.82 PDCD1 (0.39) LIPGLPLCA2
SCHEMBL3785283 0.80 GABRA1 (0.48) LIPGLPLGABRA1GABRB2
SCHEMBL1690451 0.80 CA2 (0.30) LIPGLPLCA2
SCHEMBL28184235 0.80 GABRA1 (0.41) GABRA1GABRB2
SCHEMBL3938364 0.80 CA2 (0.43) LIPGLPLCA2
SCHEMBL28980698 0.73 LIPG (0.37) LIPGLPLGABRA1GABRB2
SCHEMBL9838545 0.72 GABRA1 (0.36) GABRA1GABRB2
SCHEMBL30597484 0.71 TYR (0.47) GABRA1GABRB2
SCHEMBL4888228 0.71 TYR (0.47) GABRA1GABRB2
SCHEMBL15944442 0.71 LIPG (0.39) LIPGLPLCA2

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-7919008-B2 Liquid crystal composition comprising novel silicon containing compounds and liquid crystal display device using the same LG CHEM, LTD. (KR) 2011-04-05 US disclosed