SCHEMBL5496798

SCHEMBL5496798

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
SCHEMBL5501689 1.00 IL6ST (0.45) IL6STPPARANAAAIDH1FAAH
SCHEMBL5501688 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 8 patents. 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
US-7022825-B2 Polyketides and antibiotics KOSAN BIOSCIENCES, INC. (US) 2006-04-04 US disclosed
US-20030096374-A1 Preparation of ketide ester; obtain benzoxazolone derivative, incubate with polyketide synthase, recover ketide oligomer ASHLEY GARY (US) 2003-05-22 US disclosed
US-20030092140-A1 Novel polyketides and antibiotics ASHLEY GARY (US) 2003-05-15 US disclosed
US-6492562-B1 INVENTION ALSO RELATES TO NOVEL INTERMEDIATES AND THE RESULTING MODIFIED POLYKETIDES AND ANTIBIOTICS. KOSAN BIOSCIENCES, INC. 2002-12-10 US disclosed
EP-1144375-A2 SYNTHESIS OF OLIGOKETIDES Kosan Biosciences (US) 2001-10-17 EP disclosed
WO-2000044717-A9 SYNTHESIS OF OLIGOKETIDES 2001-08-23 WO disclosed
WO-2000044717-A2 SYNTHESIS OF OLIGOKETIDES KOSAN BIOSCIENCES, INC. (US) 2000-08-03 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030096374-A1 Preparation of ketide ester; obtain benzoxazolone derivative, incubate with polyketide synthase, recover ketide oligomer COASY, KARS1, ACOT7 IL6ST 1869/4885PPARA 2804/4885NAAA 684/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.