SCHEMBL7797511

SCHEMBL7797511

C=C[C@@H](O)[C@H](C)C(=O)N1C(=O)OCC1Cc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
IL6ST P40189 5/20 0.52
PPARA Q07869 1/20 0.44
NAAA Q02083 1/20 0.39
IDH1 O75874 8/20 0.39
FAAH O00519 1/20 0.38
STAT3 P40763 1/20 0.37
CSNK2B P67870 1/20 0.37
CSNK2A1 P68400 1/20 0.37
AGTR2 P50052 1/20 0.35

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
SCHEMBL19018653 1.00 IL6ST (0.52) IL6STPPARANAAAIDH1FAAH
SCHEMBL5500880 1.00 IL6ST (0.52) IL6STPPARANAAAIDH1FAAH
SCHEMBL5500159 0.90 IL6ST (0.54) IL6STPPARANAAAIDH1FAAH
SCHEMBL3962683 0.89 IL6ST (0.49) IL6STPPARANAAAIDH1FAAH
SCHEMBL3960159 0.89 IL6ST (0.49) IL6STPPARANAAAIDH1FAAH
SCHEMBL20536993 0.87 IL6ST (0.49) IL6STPPARANAAAIDH1FAAH
SCHEMBL29589364 0.87 IL6ST (0.49) IL6STPPARANAAAIDH1FAAH
SCHEMBL14690910 0.87 IL6ST (0.49) IL6STPPARANAAAIDH1FAAH
SCHEMBL3967160 0.87 IL6ST (0.49) IL6STPPARANAAAIDH1FAAH
SCHEMBL3960613 0.87 IL6ST (0.49) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1144375-A2 SYNTHESIS OF OLIGOKETIDES Kosan Biosciences (US) 2001-10-17 EP disclosed
WO-2000044717-A2 SYNTHESIS OF OLIGOKETIDES KOSAN BIOSCIENCES, INC. (US) 2000-08-03 WO disclosed