SCHEMBL10195671

SCHEMBL10195671

CCOC(=O)OC1=C(c2cc(Oc3ccc(C#N)cc3F)ccc2CC)C(=O)C(C)(C)OC1(C)C

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32
KDM4E B2RXH2 2/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
CRHBP P24387 1/20 0.31
CRHR2 Q13324 1/20 0.31
ALK Q9UM73 1/20 0.31
TBXA2R P21731 2/20 0.31
PTGS1 P23219 1/20 0.31
PTGS2 P35354 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
GPR119 Q8TDV5 3/20 0.30
USP30 Q70CQ3 1/20 0.30
HTR2A P28223 2/20 0.30
KCNH2 Q12809 2/20 0.30
SLC6A4 P31645 1/20 0.30
EPAS1 Q99814 1/20 0.30

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
SCHEMBL10195672 0.94 KDM4E (0.32) KDM4ETBXA2RLMNAMAPT
SCHEMBL10254129 0.93 TBXA2R (0.33) TBXA2RGPR119HTR2AKCNH2SLC6A4
SCHEMBL416035 0.92 TBXA2R (0.32) FFAR1FFAR4TBXA2RGPR119USP30
SCHEMBL10195667 0.91 TBXA2R (0.31) FFAR1FFAR4TBXA2RGPR119USP30
SCHEMBL10195668 0.89 TBXA2R (0.32) FFAR1FFAR4TBXA2RGPR119USP30
SCHEMBL16351668 0.89 KMT2A (0.37) KDM4EMEN1KMT2ACRHBPCRHR2
SCHEMBL10195099 0.85 HTR2A (0.33) FFAR1FFAR4TBXA2RGPR119HTR2A
SCHEMBL16351687 0.83 KDM4E (0.37) FFAR1KDM4EMEN1KMT2ACRHBP
SCHEMBL16351673 0.81 PPARG (0.33) KDM4EMEN1KMT2ACRHBPCRHR2
SCHEMBL16351686 0.80 PPARG (0.33) KDM4EMEN1KMT2ACRHBPCRHR2

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 FFAR1 1022/4885FFAR4 1065/4885KDM4E 712/4885
US-20120021907-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 FFAR1 752/4885FFAR4 1124/4885KDM4E 1092/4885

“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.