SCHEMBL4875622

SCHEMBL4875622

CC(=O)NCCNC(=O)c1sc(NC(C)=O)nc1CCc1ccc(N(C(=O)O)C(C)(C)C)cc1

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 16/20 0.40
PIK3CG P48736 1/20 0.34
PPARA Q07869 1/20 0.34
USP28 Q96RU2 1/20 0.34
PIK3CD O00329 1/20 0.33

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
SCHEMBL4991524 0.91 AOC3 (0.40) AOC3PPARAUSP28PIK3CD
SCHEMBL4875983 0.90 AOC3 (0.38) AOC3
SCHEMBL4982462 0.89 SCD (0.46) AOC3
SCHEMBL4875643 0.88 AOC3 (0.39) AOC3
SCHEMBL6463171 0.86 AOC3 (0.44) AOC3
SCHEMBL4875577 0.86 PPARA (0.44) AOC3PPARA
SCHEMBL4863646 0.86 AOC3 (0.47) AOC3PPARA
SCHEMBL4983295 0.85 AOC3 (0.42) AOC3
SCHEMBL4874736 0.84 PPARA (0.46) AOC3PPARA
SCHEMBL4986159 0.84 AOC3 (0.37) AOC3

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
US-7442715-B2 Thiazole derivatives ASTELLAS PHARMA INC. (JP) 2008-10-28 US disclosed
US-20060276521-A1 Thiazole derivatives ASTELLAS PHARMA INC. (JP) 2006-12-07 US 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-20060276521-A1 Thiazole derivatives VCAM1, ICAM1, TXNL1 AOC3 782/4885PIK3CG 4698/4885PPARA 1215/4885

“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.