SCHEMBL16915399

SCHEMBL16915399

Cc1ccc(Oc2ncc(Cl)cn2)c(Br)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.47
CYP2C19 P33261 3/20 0.47
CYP3A4 P08684 2/20 0.47
SLC6A2 P23975 3/20 0.42
SLC6A4 P31645 3/20 0.42
CYP2D6 P10635 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
HTT P42858 1/20 0.41
PRKAG1 P54619 1/20 0.40
PRKAA1 Q13131 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
PRKAB1 Q9Y478 1/20 0.40
L3MBTL1 Q9Y468 7/20 0.40
TDP1 Q9NUW8 5/20 0.40
MAPT P10636 4/20 0.40
HPGD P15428 3/20 0.40
ALDH1A1 P00352 2/20 0.40
NPC1 O15118 1/20 0.40

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
SCHEMBL30811086 0.76 TDP1 (0.58) CYP1A2CYP2C19CYP3A4CYP2D6MEN1
SCHEMBL2400792 0.76 TDP1 (0.58) CYP1A2CYP2C19CYP3A4CYP2D6MEN1
SCHEMBL7131517 0.72 CYP1A2 (0.40) CYP1A2CYP2C19CYP2D6MEN1KMT2A
SCHEMBL14465585 0.71 TTR (0.58) CYP1A2CYP2C19CYP3A4SLC6A2CYP2D6
SCHEMBL30466091 0.71 CYP3A4 (0.57) CYP1A2CYP2C19CYP3A4SLC6A2SLC6A4
SCHEMBL9770811 0.71 CYP3A4 (0.57) CYP1A2CYP2C19CYP3A4SLC6A2SLC6A4
SCHEMBL9195683 0.70 CYP1A2 (0.62) CYP1A2CYP2C19CYP3A4CYP2D6NPSR1
SCHEMBL8298117 0.70 CYP1A2 (0.46) CYP1A2CYP2C19SLC6A4CYP2D6MEN1
SCHEMBL31532195 0.69 CYP1A2 (0.45) CYP1A2CYP2C19CYP3A4CYP2D6NPSR1
SCHEMBL9192280 0.69 L3MBTL1 (0.47) CYP1A2CYP2C19CYP3A4CYP2D6NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111574510-B Pyrimidine as herbicide Oxyphenyl derivatives FMC 公司 2025-03-07 CN disclosed
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 CYP1A2 34/4885CYP2C19 143/4885CYP3A4 111/4885
US-10654840-B2 Pyrimidinyloxy benzene derivatives as herbicides DDT, NQO2, CBR3 CYP1A2 34/4885CYP2C19 143/4885CYP3A4 111/4885
US-20200270238-A1 PYRIMIDINYLOXY BENZENE DERIVATIVES AS HERBICIDES DDT, NQO2, CBR3 CYP1A2 34/4885CYP2C19 143/4885CYP3A4 111/4885
US-20160333000-A1 PYRIMIDINYLOXY BENZENE DERIVATIVES AS HERBICIDES DDT, NQO2, CBR3 CYP1A2 34/4885CYP2C19 143/4885CYP3A4 111/4885
US-11447476-B2 Pyrimidinyloxy benzene derivatives as herbicides DDT, NQO2, CBR3 CYP1A2 34/4885CYP2C19 143/4885CYP3A4 111/4885
US-20190084972-A1 PYRIMIDINYLOXY BENZENE DERIVATIVES AS HERBICIDES DDT, NQO2, CBR3 CYP1A2 34/4885CYP2C19 143/4885CYP3A4 111/4885

“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.