SCHEMBL5223519

SCHEMBL5223519

O=C(COC(=O)O)COC(=O)O

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33
CTH P32929 1/20 0.33
CBS P35520 1/20 0.33
THPO P40225 1/20 0.33
THRB P10828 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
SCHEMBL17786013 0.84
SCHEMBL3057906 0.79
SCHEMBL30288115 0.76
SCHEMBL11025266 0.76 TDP1 (0.30)
SCHEMBL7047073 0.73 TSHR (0.30) TSHRCTHCBSTHPO
SCHEMBL4440753 0.73
SCHEMBL10390675 0.73
SCHEMBL13622944 0.73 TSHR (0.30) TSHRCTHCBSTHPO
SCHEMBL16046345 0.73 OR51E2 (0.40) TSHRCTHCBSTHPO
SCHEMBL28087733 0.73 TSHR (0.43) TSHRCTHCBSTHPOTHRB

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-2823886-B1 Method of making hydroprocessing catalyst ADVANCED REFINING TECHNOLOGIES LLC (US) 2019-08-14 EP claimed
EP-1819705-A1 METHOD FOR PREPARING HEXAHYDRO-8-HYDROXY-2,6-METHANO-2H-CHINOLIZIN-3(4H)-ONE ESTERS Cilag Ltd. (CH) 2007-08-22 EP disclosed
WO-2006056081-A1 METHOD FOR PREPARING HEXAHYDRO-8-HYDROXY-2,6-METHANO-2H-CHINOLIZIN-3(4H)-ONE ESTERS CILAG LTD. (CH) 2006-06-01 WO disclosed