SCHEMBL6605212

SCHEMBL6605212

CC(C)(C)OC(=O)ON(C(=O)OC(C)(C)C)[C@H](CSCc1cnc2ccsc2c1)c1ccccc1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.32
PPARA Q07869 3/20 0.32
PPARD Q03181 2/20 0.31
HTR2C P28335 1/20 0.31
SLC6A4 P31645 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
SCHEMBL6608416 0.91 PPARG (0.34) PPARGPPARA
SCHEMBL6606805 0.87 MASP2 (0.33) PPARGPPARAPPARDHTR2CSLC6A4
SCHEMBL6609993 0.87 SCN9A (0.35) PPARGPPARAPPARD
SCHEMBL6403984 0.85 MMP13 (0.30)
SCHEMBL6605583 0.80 TRPM8 (0.40) PPARGPPARAPPARD
SCHEMBL6607189 0.78 PPARG (0.33) PPARGPPARA
SCHEMBL6400585 0.77 TRPM8 (0.38) PPARGPPARAPPARDHTR2C
SCHEMBL6399629 0.76 ADORA2A (0.31)
SCHEMBL6404188 0.75 NPC1 (0.34)
SCHEMBL6399472 0.72 MASP2 (0.33)

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-1289980-B1 BICYCLYL OR HETEROBICYCLYLMETHANESULFONYLAMINO-SUBSTITUTED N-HYDROXYFORMAMIDES SMITHKLINE BEECHAM PLC (GB) 2004-11-17 EP disclosed