SCHEMBL10195066

SCHEMBL10195066

CC1(C)OC(C)(C)C(O)=C(c2cc(Oc3ccc(Cl)cc3)ccc2OC(F)(F)F)C1=O

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PNLIP P16233 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
ELANE P08246 1/20 0.33
CCR6 P51684 1/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
CHRM5 P08912 1/20 0.32
LMNA P02545 1/20 0.32
DHODH Q02127 1/20 0.31
SCN9A Q15858 2/20 0.31
AR P10275 1/20 0.31
SCN3A Q9NY46 1/20 0.31
ABL1 P00519 1/20 0.31

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
SCHEMBL10195067 0.82 MAOA (0.40) MAOAMAOBELANELMNA
SCHEMBL10195021 0.81 MAOB (0.39) MAOAMAOBELANEHTR2ALMNA
SCHEMBL10121083 0.80 MAOA (0.33) MAOAMAOBLMNA
SCHEMBL10195427 0.80 PTGER4 (0.35) CHRM5
SCHEMBL10192900 0.79 ELANE (0.38) MAOAMAOBELANEHTR2ALMNA
SCHEMBL10195606 0.78 MAOB (0.37) MAOAMAOBELANELMNA
SCHEMBL10195622 0.78 MMP9 (0.33)
SCHEMBL411018 0.76 PNLIP (0.36) PNLIPMAOAMAOBCCR6CYP11B1
SCHEMBL10195068 0.76 LPAR2 (0.38) PNLIPHTR2ALMNA
SCHEMBL16351654 0.75 HPGD (0.30)

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 PNLIP 2677/4885MAOA 1359/4885MAOB 1215/4885
US-20120021907-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 PNLIP 3374/4885MAOA 2359/4885MAOB 2064/4885

“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.