SCHEMBL6674835

SCHEMBL6674835

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

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 1/20 0.33
TAS1R1 Q7RTX1 1/20 0.33
PPARG P37231 2/20 0.32
PPARD Q03181 1/20 0.32
PPARA Q07869 1/20 0.32
MAPT P10636 3/20 0.31
DNTT P04053 1/20 0.31
UCHL3 P15374 1/20 0.30

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
SCHEMBL6674832 1.00 TAS1R3 (0.33) TAS1R3TAS1R1PPARGPPARDPPARA
SCHEMBL6680654 0.71 ALDH1A1 (0.41) PPARGPPARDPPARADNTT
SCHEMBL10712297 0.71 GALR3 (0.40) PPARGPPARDPPARAMAPTDNTT
SCHEMBL6676582 0.70 PPARG (0.41) PPARGPPARDPPARADNTT
SCHEMBL6680397 0.68 PPARG (0.48) PPARGPPARDPPARADNTT
SCHEMBL6676379 0.68 PPARG (0.48) PPARGPPARDPPARADNTT
Methyl Alcohol SCHEMBL6679682 0.67 POLB (0.39)
SCHEMBL9196528 0.65 MAPT (0.44) TAS1R3TAS1R1PPARGMAPT
SCHEMBL11076464 0.65 MAPT (0.44) TAS1R3TAS1R1PPARGMAPT
SCHEMBL30648426 0.65 MAPT (0.44) TAS1R3TAS1R1PPARGMAPT

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