SCHEMBL6676582

SCHEMBL6676582

CCCCC(=O)OC1C=CC(=O)C1OC(=O)CCCC

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.41
PPARD Q03181 1/20 0.41
PPARA Q07869 1/20 0.41
MIF P14174 1/20 0.38
DNTT P04053 1/20 0.38
NAAA Q02083 2/20 0.37
NLRP3 Q96P20 1/20 0.36
PRKCA P17252 6/20 0.36
NFKB1 P19838 1/20 0.35
STAT1 P42224 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 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
SCHEMBL6675203 0.95 PPARG (0.46) PPARGPPARDPPARADNTTNAAA
SCHEMBL6680397 0.94 PPARG (0.48) PPARGPPARDPPARADNTTNAAA
SCHEMBL6676379 0.94 PPARG (0.48) PPARGPPARDPPARADNTTNAAA
SCHEMBL6675746 0.94 PPARG (0.48) PPARGPPARDPPARADNTTNAAA
SCHEMBL6679387 0.90 NLRP3 (0.38) PPARGPPARDPPARADNTTNLRP3
SCHEMBL6680654 0.83 ALDH1A1 (0.41) PPARGPPARDPPARADNTTNFKB1
SCHEMBL6676518 0.80 TRPA1 (0.35) PPARGPPARDPPARAMIFDNTT
SCHEMBL2238652 0.71 LMNA (0.47) NAAAPRKCA
SCHEMBL6678682 0.71 POLB (0.40) PPARGPPARDPPARANLRP3
SCHEMBL2240258 0.70 NAAA (0.41) NAAAPRKCA

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-1112742-B1 REMEDIES OR PREVENTIVES CONTAINING CYCLOPENTENONE COMPOUNDS AS THE ACTIVE INGREDIENT TAKARA BIO INC (JP) 2004-11-03 EP claimed
EP-1112742-B1 REMEDIES OR PREVENTIVES CONTAINING CYCLOPENTENONE COMPOUNDS AS THE ACTIVE INGREDIENT TAKARA BIO INC (JP) 2004-11-03 EP disclosed