SCHEMBL6676586

SCHEMBL6676586

CCCCCOC1C=CC(=O)C1OCCCCC

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.53
PPARA Q07869 4/20 0.53
PPARD Q03181 3/20 0.53
DNTT P04053 1/20 0.40
GBA1 P04062 1/20 0.38
TSHR P16473 2/20 0.34
TP53 P04637 1/20 0.34
CYP3A4 P08684 1/20 0.34
MAPK1 P28482 1/20 0.34
GSTA2 P09210 2/20 0.33
GSTP1 P09211 2/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
GSTM1 P09488 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
SCHEMBL10562109 0.71 PPARG (0.43) PPARGPPARAPPARDDNTTGBA1
SCHEMBL11757677 0.71 PPARG (0.43) PPARGPPARAPPARDDNTTGBA1
SCHEMBL11763240 0.71 PPARG (0.40) PPARGPPARAPPARDDNTTGBA1
SCHEMBL5616444 0.70 PPARG (1.00) PPARGPPARAPPARDTSHRALDH1A1
SCHEMBL5612837 0.70 PPARG (1.00) PPARGPPARAPPARDTSHRALDH1A1
SCHEMBL11764825 0.70 PPARG (0.42) PPARGPPARAPPARDDNTTGBA1
SCHEMBL10563094 0.70 PPARG (0.42) PPARGPPARAPPARDDNTTGBA1
SCHEMBL10562939 0.69 PPARG (0.47) PPARGPPARAPPARDDNTTGBA1
SCHEMBL10559876 0.69 PPARG (0.47) PPARGPPARAPPARDDNTTGBA1
SCHEMBL10561194 0.69 PPARG (0.44) PPARGPPARAPPARDDNTTGBA1

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