SCHEMBL5501689

SCHEMBL5501689

CC[C@@H](O)[C@@H](C)C(=O)[C@@H](C)C(=O)N1C(=O)OC[C@@H]1Cc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
IL6ST P40189 2/20 0.45
PPARA Q07869 3/20 0.45
NAAA Q02083 1/20 0.38
IDH1 O75874 8/20 0.38
FAAH O00519 1/20 0.37
CSNK2B P67870 1/20 0.36
CSNK2A1 P68400 1/20 0.36
PPARG P37231 1/20 0.35
LTB4R Q15722 1/20 0.34
LTB4R2 Q9NPC1 1/20 0.34
TRPA1 O75762 1/20 0.34

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
SCHEMBL5858039 1.00 IL6ST (0.45) IL6STPPARANAAAIDH1FAAH
SCHEMBL5501688 1.00 IL6ST (0.45) IL6STPPARANAAAIDH1FAAH
SCHEMBL5496798 1.00 IL6ST (0.45) IL6STPPARANAAAIDH1FAAH
SCHEMBL19018652 0.91 IL6ST (0.51) IL6STPPARANAAAIDH1FAAH
SCHEMBL7925690 0.91 IL6ST (0.51) IL6STPPARANAAAIDH1FAAH
SCHEMBL1195569 0.91 IL6ST (0.51) IL6STPPARANAAAIDH1FAAH
SCHEMBL1194246 0.91 IL6ST (0.51) IL6STPPARANAAAIDH1FAAH
SCHEMBL5515125 0.91 IL6ST (0.51) IL6STPPARANAAAIDH1FAAH
SCHEMBL17706643 0.87 IL6ST (0.43) IL6STPPARANAAAIDH1FAAH
SCHEMBL5500578 0.85 IL6ST (0.48) IL6STPPARANAAAIDH1FAAH

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-1754700-A2 Synthesis of oligoketides Kosan Biosciences, Inc. (US) 2007-02-21 EP disclosed