SCHEMBL3636766

SCHEMBL3636766

CN(C)C(=O)c1nc(Br)c(C=O)n1COCC[Si](C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 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
SCHEMBL3637434 0.85 NPC1 (0.33) NPC1
SCHEMBL5214265 0.78 DGAT1 (0.34) NPC1
SCHEMBL3635556 0.76 DGAT1 (0.31)
SCHEMBL3033883 0.75 DGAT1 (0.30)
SCHEMBL3028184 0.75 MLKL (0.34)
SCHEMBL1108611 0.74 DGAT1 (0.33)
SCHEMBL3635834 0.74
SCHEMBL3461380 0.73 MAPK1 (0.32)
SCHEMBL3635616 0.71
SCHEMBL1316068 0.70 NPC1 (0.35) NPC1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8304419-B2 Chemical compounds GLAXOSMITHKLINE LLC (US) 2012-11-06 US disclosed
EP-2166856-A1 CHEMICAL COMPOUNDS GlaxoSmithKline LLC (US) 2010-03-31 EP disclosed
WO-2008154271-A1 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2008-12-18 WO disclosed