SCHEMBL10195314

SCHEMBL10195314

CCc1ccc(Oc2cccc(C(F)(F)F)c2)cc1C1=C(O)C(C)(C)OC(C)(C)C1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.39
CETP P11597 2/20 0.35
PPARG P37231 2/20 0.35
MMP2 P08253 1/20 0.35
MMP3 P08254 1/20 0.35
MMP9 P14780 1/20 0.35
MMP8 P22894 1/20 0.35
MMP13 P45452 1/20 0.35
MMP14 P50281 1/20 0.35
MAPT P10636 2/20 0.35
LTA4H P09960 1/20 0.35
SCN9A Q15858 1/20 0.35
MCL1 Q07820 1/20 0.35
HTT P42858 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
USP2 O75604 1/20 0.34
LMNA P02545 1/20 0.34
THRA P10827 1/20 0.34
THRB P10828 1/20 0.34
PTPN2 P17706 1/20 0.34

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
SCHEMBL10195200 0.91 MMP14 (0.35) CETPPPARGMMP2MMP3MMP9
SCHEMBL10195013 0.87 MMP14 (0.37) PPARGMMP2MMP3MMP9MMP13
SCHEMBL10195346 0.85 FFAR1 (0.34) KIF11CETPTHRB
SCHEMBL10195272 0.85 NPC1 (0.38) SCN9AL3MBTL1ALDH1A1MAPK14FAAH
SCHEMBL10195202 0.85 FFAR1 (0.42) PPARGMRGPRX4
SCHEMBL10195182 0.85 SLC6A4 (0.34) PPARGMAPTL3MBTL1LMNATHRA
SCHEMBL10195114 0.85 MAOB (0.33) LMNAMRGPRX4MAOBALDH1A1
SCHEMBL10195427 0.85 PTGER4 (0.35) MMP2MMP3MMP9MMP13
SCHEMBL10195071 0.85 TP53 (0.38) PPARGMMP2MMP3MMP9MMP8
SCHEMBL10195345 0.84 THRB (0.40) CETPTHRATHRBMRGPRX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2387569-B1 HERBCIDES SYNGENTA LTD (GB) 2016-06-15 EP disclosed
US-20140378305-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2014-12-25 US disclosed
US-20140378305-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2014-12-25 US disclosed
US-8865623-B2 Herbicidally active cyclic diones and derivatives thereof, processes for their preparation, compositions, and method of controlling weeds SYNGENTA LIMITED (GB) 2014-10-21 US disclosed
US-8865623-B2 Herbicidally active cyclic diones and derivatives thereof, processes for their preparation, compositions, and method of controlling weeds SYNGENTA LIMITED (GB) 2014-10-21 US disclosed
US-20120021907-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-01-26 US disclosed
US-20120021907-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-01-26 US disclosed
WO-2010081755-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2010-07-22 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140378305-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 KIF11 3173/4885CETP 4568/4885PPARG 131/4885
US-20120021907-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 KIF11 3091/4885CETP 4704/4885PPARG 101/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.