SCHEMBL16915411

SCHEMBL16915411

FC(F)(F)Oc1ccc(-c2ccccc2Oc2ncc(Cl)cn2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 2/20 0.43
▸ GRIN2B Q13224 3/20 0.42
▸ RXRA P19793 2/20 0.42
▸ GRIN1 Q05586 2/20 0.42
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ ALOX5AP P20292 5/20 0.41
▸ FEN1 P39748 5/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ SCN9A Q15858 1/20 0.39
▸ TRPA1 O75762 1/20 0.39
▸ CHRM5 P08912 1/20 0.38

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
SCHEMBL31532198 1.00 FFAR4 (0.43) FFAR4GRIN2BRXRAGRIN1CYP1A2
SCHEMBL16915422 0.83 KMT2A (0.53) CYP1A2CYP3A4CYP2D6CYP2C19L3MBTL1
SCHEMBL16915413 0.79 NPSR1 (0.50) CYP1A2CYP3A4CYP2D6CYP2C19L3MBTL1
SCHEMBL31532178 0.75 ALOX5AP (0.45) CYP1A2CYP3A4CYP2D6CYP2C19L3MBTL1
SCHEMBL16915377 0.75 ALOX5AP (0.45) CYP1A2CYP3A4CYP2D6CYP2C19L3MBTL1
SCHEMBL18223959 0.73 ADORA1 (0.43) CYP1A2CYP3A4CYP2D6CYP2C19L3MBTL1
SCHEMBL31532189 0.73 ADORA1 (0.43) CYP1A2CYP3A4CYP2D6CYP2C19L3MBTL1
SCHEMBL17840231 0.73 GPR3 (0.50) FFAR4FFAR1
SCHEMBL9192280 0.73 L3MBTL1 (0.47) GRIN2BRXRAGRIN1CYP1A2CYP3A4
SCHEMBL22634082 0.72 FFAR4 (0.46) FFAR4GRIN2BSCN9ATRPA1CHRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11447476-B2 Pyrimidinyloxy benzene derivatives as herbicides FMC CORPORATION (US) 2022-09-20 — — US disclosed
US-20200270238-A1 PYRIMIDINYLOXY BENZENE DERIVATIVES AS HERBICIDES FMC CORP (US) 2020-08-27 — — US disclosed
CN-111574510-A Pyrimidinyloxybenzene derivatives as herbicides FMC 公司 2020-08-25 — — CN disclosed
CN-105916849-B Pyrimidinyloxybenzene derivatives as herbicides FMC公司 2020-07-07 — — CN disclosed
US-10654840-B2 Pyrimidinyloxy benzene derivatives as herbicides FMC CORPORATION (US) 2020-05-19 — — US disclosed
US-20190084972-A1 PYRIMIDINYLOXY BENZENE DERIVATIVES AS HERBICIDES FMC CORP (US) 2019-03-21 — — US disclosed
EP-3094631-B1 PYRIMIDINYLOXY BENZENE DERIVATIVES AS HERBICIDES FMC CORP (US) 2019-01-09 — — EP disclosed
US-10131652-B2 Pyrimidinyloxy benzene derivatives as herbicides FMC CORPORATION 2018-11-20 — — US disclosed
EP-3094631-A1 PYRIMIDINYLOXY BENZENE DERIVATIVES AS HERBICIDES E. I. du Pont de Nemours and Company (US) 2016-11-23 — — EP disclosed
US-20160333000-A1 PYRIMIDINYLOXY BENZENE DERIVATIVES AS HERBICIDES FMC CORPORATION 2016-11-17 — — US disclosed
WO-2015108779-A1 PYRIMIDINYLOXY BENZENE DERIVATIVES AS HERBICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2015-07-23 — — 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 (6 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-10131652-B2 Pyrimidinyloxy benzene derivatives as herbicides DDT, NQO2, CBR3 FFAR4 3561/4885GRIN2B 1671/4885RXRA 965/4885
US-10654840-B2 Pyrimidinyloxy benzene derivatives as herbicides DDT, NQO2, CBR3 FFAR4 3561/4885GRIN2B 1671/4885RXRA 965/4885
US-20200270238-A1 PYRIMIDINYLOXY BENZENE DERIVATIVES AS HERBICIDES DDT, NQO2, CBR3 FFAR4 3561/4885GRIN2B 1671/4885RXRA 965/4885
US-20160333000-A1 PYRIMIDINYLOXY BENZENE DERIVATIVES AS HERBICIDES DDT, NQO2, CBR3 FFAR4 3561/4885GRIN2B 1671/4885RXRA 965/4885
US-11447476-B2 Pyrimidinyloxy benzene derivatives as herbicides DDT, NQO2, CBR3 FFAR4 3561/4885GRIN2B 1671/4885RXRA 965/4885
US-20190084972-A1 PYRIMIDINYLOXY BENZENE DERIVATIVES AS HERBICIDES DDT, NQO2, CBR3 FFAR4 3561/4885GRIN2B 1671/4885RXRA 965/4885

“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.

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