SCHEMBL16660866

SCHEMBL16660866

Cc1nc(-c2ccc(B3OC(C)(C)C(C)(C)O3)cc2)n(COCC[Si](C)(C)C)n1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 13/20 0.40
LPL P06858 12/20 0.40
SNCA P37840 1/20 0.38
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
DGAT1 O75907 2/20 0.33
F11 P03951 1/20 0.33
IRAK4 Q9NWZ3 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
SCHEMBL16661160 0.86 LPL (0.39) LIPGLPLSNCACA1CA2
SCHEMBL10276614 0.82 LPL (0.40) LIPGLPLSNCACA1CA2
SCHEMBL26094602 0.81 LIPG (0.39) LIPGLPLSNCACA1CA2
SCHEMBL22967310 0.80 DGAT1 (0.43) LIPGLPLSNCACA1CA2
SCHEMBL16277686 0.78 LIPG (0.38) LIPGLPLSNCACA1CA2
SCHEMBL16660858 0.78 DGAT1 (0.39) LIPGLPLSNCACA1CA2
SCHEMBL30051335 0.78 LPL (0.40) LIPGLPLSNCACA1CA2
SCHEMBL1440980 0.78 LPL (0.40) LIPGLPLSNCACA1CA2
SCHEMBL23294549 0.77 LPL (0.41) LIPGLPLSNCACA1CA2
SCHEMBL26093683 0.77 LIPG (0.39) LIPGLPLSNCACA1CA2

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-2862856-A1 AROMATIC HETEROCYCLIC COMPOUND Mitsubishi Tanabe Pharma Corporation (JP) 2015-04-22 EP disclosed