SCHEMBL6680397

SCHEMBL6680397

CCCCCCCCCCCCCC(=O)OC1C=CC(=O)C1OC(=O)CCCCCCCCCCCCC

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.48
PPARD Q03181 1/20 0.48
PPARA Q07869 1/20 0.48
NAAA Q02083 2/20 0.45
NLRP3 Q96P20 1/20 0.43
PRKCA P17252 6/20 0.43
LMNA P02545 2/20 0.42
DNTT P04053 1/20 0.42
POLM Q9NP87 1/20 0.41
POLK Q9UBT6 1/20 0.41
POLL Q9UGP5 1/20 0.41
POLH Q9Y253 1/20 0.41
DGKA P23743 1/20 0.41

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
SCHEMBL6676379 1.00 PPARG (0.48) PPARGPPARDPPARANAAANLRP3
SCHEMBL6675746 1.00 PPARG (0.48) PPARGPPARDPPARANAAANLRP3
SCHEMBL6675203 0.98 PPARG (0.46) PPARGPPARDPPARANAAANLRP3
SCHEMBL6676582 0.94 PPARG (0.41) PPARGPPARDPPARANAAANLRP3
SCHEMBL6680654 0.81 ALDH1A1 (0.41) PPARGPPARDPPARADNTT
SCHEMBL6676518 0.78 TRPA1 (0.35) PPARGPPARDPPARALMNADNTT
SCHEMBL2239670 0.73 DGKA (0.52) NAAAPRKCALMNADGKA
SCHEMBL5080113 0.72 NAAA (0.50) NAAAPRKCALMNADGKA
SCHEMBL5080133 0.72 NAAA (0.50) NAAAPRKCALMNADGKA
SCHEMBL5079233 0.72 NAAA (0.50) NAAAPRKCALMNADGKA

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