SCHEMBL11011671

SCHEMBL11011671

CC(=O)CC(O)C(C)Oc1ccc(Oc2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 2/20 0.42
▸ PPARA Q07869 2/20 0.42
▸ MMP2 P08253 3/20 0.41
▸ MMP9 P14780 3/20 0.41
▸ FNTA P49354 1/20 0.40
▸ FNTB P49356 1/20 0.40
▸ MAOB P27338 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ MAPK14 Q16539 1/20 0.40
▸ SCN9A Q15858 2/20 0.39
▸ FPR2 P25090 1/20 0.39
▸ SLC6A9 P48067 1/20 0.39
▸ FFAR1 O14842 2/20 0.38

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
SCHEMBL11003292 0.89 FNTA (0.48) PPARGPPARAMMP2MMP9FNTA
SCHEMBL11087095 0.88 PPARG (0.41) PPARGPPARAMMP2MMP9FNTA
SCHEMBL11003578 0.87 MMP2 (0.42) PPARGPPARAMMP2MMP9FNTA
SCHEMBL10999754 0.86 PPARG (0.40) PPARGPPARAMMP2MMP9FNTA
SCHEMBL11075585 0.86 LMNA (0.55) MMP2MMP9SCN9A
SCHEMBL10877525 0.85 PTPN1 (0.39) PPARGPPARAMMP2MMP9FNTA
SCHEMBL11081026 0.83 PPARG (0.40) PPARGPPARAMMP2MMP9FNTA
SCHEMBL10999758 0.83 PPARA (0.38) PPARGPPARAMMP2MMP9FNTA
SCHEMBL11077067 0.81 SLC6A4 (0.37) MMP2MMP9MEN1KMT2ASCN9A
SCHEMBL11077064 0.81 SLC6A4 (0.37) MMP2MMP9MEN1KMT2ASCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4522647-A Substituted phenoxyalkanediones and their herbicidal method of use ZOECON CORPORATION (US) 1985-06-11 — — US disclosed
US-4469872-A Substituted pyridyloxyphenoxyhydroxyketones ZOECON CORPORATION (US) 1984-09-04 — — US disclosed
EP-0109483-A1 Substituted phenoxyalkane diones, intermediates for these compounds and the use of phenoxyalkane diones in the control of weeds ZOECON CORPORATION (US) 1984-05-30 — — EP disclosed
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