SCHEMBL2586056

SCHEMBL2586056

CC/C=C\CC1C(=O)C=CC1CCCCCC(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 6/20 0.49
▸ PPARD Q03181 3/20 0.49
▸ PPARA Q07869 3/20 0.49
▸ TRPA1 O75762 5/20 0.48
▸ NR4A2 P43354 2/20 0.48
▸ ALDH1A1 P00352 6/20 0.46
▸ KMT2A Q03164 4/20 0.46
▸ MEN1 O00255 3/20 0.46
▸ HPGD P15428 3/20 0.46
▸ LMNA P02545 2/20 0.46
▸ POLB P06746 1/20 0.46
▸ NR4A1 P22736 1/20 0.46
▸ PTPN7 P35236 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ MAPT P10636 5/20 0.44
▸ F7 P08709 3/20 0.44
▸ F3 P13726 3/20 0.44
▸ CYP19A1 P11511 3/20 0.44
▸ OXER1 Q8TDS5 2/20 0.44

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
SCHEMBL30963742 1.00 PPARG (0.49) PPARGPPARDPPARATRPA1NR4A2
SCHEMBL30537451 1.00 PPARG (0.49) PPARGPPARDPPARATRPA1NR4A2
SCHEMBL30537450 1.00 PPARG (0.49) PPARGPPARDPPARATRPA1NR4A2
SCHEMBL4316052 1.00 PPARG (0.49) PPARGPPARDPPARATRPA1NR4A2
SCHEMBL14538124 1.00 PPARG (0.49) PPARGPPARDPPARATRPA1NR4A2
SCHEMBL31138123 1.00 PPARG (0.49) PPARGPPARDPPARATRPA1NR4A2
SCHEMBL594566 1.00 PPARG (0.49) PPARGPPARDPPARATRPA1NR4A2
SCHEMBL2984928 1.00 PPARG (0.49) PPARGPPARDPPARATRPA1NR4A2
SCHEMBL29896525 0.90 PPARG (0.52) PPARGPPARDPPARATRPA1NR4A2
SCHEMBL14035899 0.85 DNTT (0.48) PPARGPPARDPPARATRPA1NR4A2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011134539-A1 USE OF OXYLIPINS AS SAFENERS AND SAFENING HERBICIDAL COMPOSITIONS COMPRISING OXYLIPINS BASF SE (DE) 2011-11-03 — — WO disclosed
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