SCHEMBL9534115

SCHEMBL9534115

COC(=O)C=CCCCC[C@@H]1C(=O)C=C[C@@H]1O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNTT P04053 1/20 0.36
PPARG P37231 2/20 0.35
PPARD Q03181 1/20 0.35
PPARA Q07869 1/20 0.35
TRPA1 O75762 4/20 0.33
NR4A2 P43354 2/20 0.33
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
KEAP1 Q14145 1/20 0.32
NFE2L2 Q16236 1/20 0.32
HCAR2 Q8TDS4 1/20 0.32
MAPT P10636 2/20 0.32
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
HPGD P15428 1/20 0.31
NR4A1 P22736 1/20 0.31
PTPN7 P35236 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL9495622 0.76 PTGER2 (0.44) DNTTPPARGPPARDPPARATRPA1
SCHEMBL9497680 0.74 PTGER2 (0.46) DNTTPPARGPPARDPPARATRPA1
SCHEMBL16287745 0.73 HCAR2 (0.40) CNR1CNR2KEAP1NFE2L2HCAR2
SCHEMBL31681514 0.72 HCAR2 (0.55) PPARGPPARACNR1CNR2KEAP1
SCHEMBL8848785 0.71 PPARG (0.50) DNTTPPARGPPARDPPARATRPA1
SCHEMBL9535804 0.70 KEAP1 (0.32) CNR1CNR2KEAP1NFE2L2HCAR2
SCHEMBL10385891 0.70 PPARG (0.52) DNTTPPARGPPARDPPARATRPA1
SCHEMBL10617209 0.70 PPARG (0.40) DNTTPPARGPPARDPPARATRPA1
SCHEMBL10629076 0.70 PPARG (0.52) DNTTPPARGPPARDPPARATRPA1
SCHEMBL10631459 0.69 PPARG (0.44) DNTTPPARGPPARDPPARATRPA1

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-0362816-B1 Cyclopenteneheptanoic acid derivatives and method of preparation thereof SEARLE & CO (US) 1993-11-18 EP disclosed
US-4952710-A STARTING MATERIAL FOR OPTICALLY ACTIVE PROSTAGLANDINS G. D. SEARLE & CO. (US) 1990-08-28 US disclosed