SCHEMBL3634283

SCHEMBL3634283

COCc1nc(Br)c(Br)n1COCC[Si](C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.34
TSHR P16473 2/20 0.34
KMT2A Q03164 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
ALDH1A1 P00352 1/20 0.34
HTT P42858 1/20 0.34
DGAT1 O75907 2/20 0.32
LMNA P02545 1/20 0.32
RAB9A P51151 1/20 0.32

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
SCHEMBL17895929 0.90 DGAT1 (0.31) DGAT1
SCHEMBL3640575 0.85 DGAT1 (0.31) DGAT1
SCHEMBL3637817 0.84 DGAT1 (0.33) DGAT1
SCHEMBL3635834 0.82
SCHEMBL13560548 0.82 DGAT1 (0.32) DGAT1
SCHEMBL6545264 0.82 DGAT1 (0.32) DGAT1
SCHEMBL3633951 0.81 DGAT1 (0.32) DGAT1
SCHEMBL9584122 0.80 DGAT1 (0.31) DGAT1
SCHEMBL67719 0.80 DGAT1 (0.35) DGAT1
SCHEMBL13560563 0.79 DUT (0.37) DGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016109706-A1 FUSED POLYCYCLIC 2-PYRIDINONE ANTIBACTERIAL COMPOUNDS PTC THERAPEUTICS, INC. (US) 2016-07-07 WO disclosed
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