SCHEMBL11011013

SCHEMBL11011013

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

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 1/20 0.41
▸ PPARG P37231 2/20 0.41
▸ PPARA Q07869 2/20 0.41
▸ SCN9A Q15858 2/20 0.41
▸ FPR2 P25090 1/20 0.41
▸ IDH1 O75874 1/20 0.41
▸ MMP2 P08253 3/20 0.41
▸ MMP9 P14780 3/20 0.41
▸ FNTA P49354 1/20 0.40
▸ FNTB P49356 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ LTA4H P09960 1/20 0.39
▸ EPHX2 P34913 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39

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
SCHEMBL11005082 0.86 FNTA (0.46) MAPK14PPARGPPARASCN9AFPR2
SCHEMBL11010244 0.86 MAPK14 (0.43) MAPK14PPARGPPARASCN9AFPR2
SCHEMBL11010289 0.86 MAPK14 (0.43) MAPK14PPARGPPARASCN9AFPR2
SCHEMBL10880010 0.86 FNTA (0.46) MAPK14PPARGPPARASCN9AFPR2
SCHEMBL10880100 0.85 MAPK14 (0.42) MAPK14PPARGPPARASCN9AFPR2
SCHEMBL11005272 0.85 MAPK14 (0.42) MAPK14PPARGPPARASCN9AFPR2
SCHEMBL11001857 0.85 IDH1 (0.46) MAPK14PPARGPPARASCN9AFPR2
SCHEMBL10880352 0.85 IDH1 (0.46) MAPK14PPARGPPARASCN9AFPR2
SCHEMBL11075578 0.82 MAPK14 (0.44) MAPK14PPARGPPARASCN9AFPR2
SCHEMBL10999451 0.82 MMP2 (0.42) MAPK14PPARGPPARASCN9AFPR2

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
US-4522647-A Substituted phenoxyalkanediones and their herbicidal method of use ZOECON CORPORATION (US) 1985-06-11 — — 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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