SCHEMBL5484536

SCHEMBL5484536

CCOC(=O)COc1ccc([Se]Cc2sc(-c3ccc(C(F)(F)F)cc3)nc2C)cc1C

nearest known ligand 0.82

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 20/20 0.82
PPARA Q07869 16/20 0.70
PPARG P37231 9/20 0.70
FFAR1 O14842 1/20 0.51

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
SCHEMBL5483798 0.90 PPARD (1.00) PPARDPPARAPPARGFFAR1
SCHEMBL14573037 0.85 PPARD (0.73) PPARDPPARAPPARGFFAR1
SCHEMBL14573042 0.85 PPARD (0.81) PPARDPPARAPPARGFFAR1
SCHEMBL14573036 0.84 PPARD (0.66) PPARDPPARAPPARGFFAR1
SCHEMBL4853039 0.84 PPARD (0.62) PPARDPPARAPPARGFFAR1
SCHEMBL13647570 0.83 PPARD (0.82) PPARDPPARAPPARG
SCHEMBL14573032 0.83 PPARD (0.62) PPARDPPARAPPARGFFAR1
SCHEMBL14573029 0.82 PPARD (0.63) PPARDPPARAPPARGFFAR1
SCHEMBL14573039 0.82 PPARD (0.59) PPARDPPARAPPARGFFAR1
SCHEMBL14573041 0.81 PPARD (0.57) PPARDPPARAPPARGFFAR1

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
EP-1841748-B1 ORGANOSELENIUM CONTAINING COMPOUNDS AND THEIR USE SEOUL NAT UNIV IND FOUNDATION (KR) 2011-12-28 EP disclosed
EP-1841748-A1 ORGANOSELENIUM CONTAINING COMPOUNDS AND THEIR USE Kang, Heonjoong (KR) 2007-10-10 EP disclosed
WO-2006071103-A1 ORGANOSELENIUM CONTAINING COMPOUNDS AND THEIR USE KANG HEONJOONG (KR) 2006-07-06 WO disclosed