SCHEMBL10880010

SCHEMBL10880010

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

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 1/20 0.46
▸ FNTB P49356 1/20 0.46
▸ MAPK14 Q16539 1/20 0.46
▸ PPARA Q07869 3/20 0.46
▸ PPARG P37231 2/20 0.46
▸ SLC6A9 P48067 1/20 0.44
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ LTA4H P09960 1/20 0.43
▸ EPHX2 P34913 1/20 0.43
▸ FPR2 P25090 1/20 0.42
▸ SCN9A Q15858 1/20 0.42
▸ MMP2 P08253 3/20 0.42
▸ MMP9 P14780 3/20 0.42
▸ PPARD Q03181 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41

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 1.00 FNTA (0.46) FNTAFNTBMAPK14PPARAPPARG
SCHEMBL11010289 0.89 MAPK14 (0.43) FNTAFNTBMAPK14PPARAPPARG
SCHEMBL11010244 0.89 MAPK14 (0.43) FNTAFNTBMAPK14PPARAPPARG
SCHEMBL11005272 0.88 MAPK14 (0.42) FNTAFNTBMAPK14PPARAPPARG
SCHEMBL10880100 0.88 MAPK14 (0.42) FNTAFNTBMAPK14PPARAPPARG
SCHEMBL11011013 0.86 MAPK14 (0.41) FNTAFNTBMAPK14PPARAPPARG
SCHEMBL11075578 0.84 MAPK14 (0.44) FNTAFNTBMAPK14PPARAPPARG
SCHEMBL10880352 0.84 IDH1 (0.46) MAPK14PPARAPPARGKMT2AFPR2
SCHEMBL10999451 0.84 MMP2 (0.42) FNTAFNTBMAPK14PPARAPPARG
SCHEMBL11001857 0.84 IDH1 (0.46) MAPK14PPARAPPARGKMT2AFPR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0050019-B1 3-KETO-4-(4'-AROMATICALLY SUBSTITUTED-PHENOXY) COMPOUNDS, THEIR 3- ALKYLATED ENOL AND 2,3-HYDROGENATED DERIVATIVES AND THE USE THEREOF FOR THE CONTROL OF WEEDS SANDOZ AG (CH) 1986-04-09 — — EP claimed
EP-0050019-A1 3-Keto-4-(4'-aromatically substituted-phenoxy) compounds, their 3- alkylated enol and 2,3-hydrogenated derivatives and the use thereof for the control of weeds SANDOZ AG (CH) 1982-04-21 — — EP claimed
US-4561882-A HERBICIDES ZOECON CORPORATION (US) 1985-12-31 — — US disclosed
US-4529438-A A 1-(pyrid-2-yl-oxy-),4-(ester-keto-oxy)benzene compound ZOECON CORP. (US) 1985-07-16 — — US disclosed
US-4429167-A HERBICIDES ZOECON CORPORATION (US) 1984-01-31 — — US disclosed
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