SCHEMBL900663

SCHEMBL900663

C#CCN1C(=O)C(F)(F)Oc2cc(F)c(N)cc21

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.32
CYP19A1 P11511 1/20 0.32
ALDH1A1 P00352 1/20 0.31
GAA P10253 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
SCHEMBL30704859 1.00 PGR (0.32) PGRCYP19A1ALDH1A1GAA
SCHEMBL16541627 0.89 PGR (0.34) PGRCYP19A1ALDH1A1GAA
SCHEMBL28062084 0.87 PGR (0.31) PGRCYP19A1ALDH1A1GAA
SCHEMBL29901586 0.87 ALDH1A1 (0.39) PGRALDH1A1
SCHEMBL20692934 0.86 NR3C2 (0.34) PGRCYP19A1ALDH1A1GAA
SCHEMBL20693048 0.84 NR3C2 (0.36) CYP19A1ALDH1A1GAA
SCHEMBL30799184 0.84 NR3C2 (0.36) CYP19A1ALDH1A1GAA
SCHEMBL9971083 0.84 MEN1 (0.34)
SCHEMBL900752 0.84 ALDH1A1 (0.30) ALDH1A1GAA
SCHEMBL25362898 0.82

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 109 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113200985-B Pteridinone compound and preparation method and application thereof 南开大学 2022-09-09 CN disclosed
EP-3010895-B1 PROCESS FOR MANUFACTURING 4-PROPARGYLATED AMINO-BENZOXAZINONES BASF SE (DE) 2017-08-09 EP disclosed
EP-3010895-B1 PROCESS FOR MANUFACTURING 4-PROPARGYLATED AMINO-BENZOXAZINONES BASF SE (DE) 2017-08-09 EP disclosed
US-9518045-B2 Process for manufacturing benzoxazinones BASF SE (DE) 2016-12-13 US disclosed
US-9518045-B2 Process for manufacturing benzoxazinones BASF SE (DE) 2016-12-13 US disclosed
US-9518045-B2 Process for manufacturing benzoxazinones BASF SE (DE) 2016-12-13 US disclosed
EP-2885281-B1 CARBAMAT-BENZOXAZINONES USEFUL FOR PREPARING TRIAZIN-BENZOXAZINONES BASF SE (DE) 2016-12-07 EP disclosed
EP-2885281-B1 CARBAMAT-BENZOXAZINONES USEFUL FOR PREPARING TRIAZIN-BENZOXAZINONES BASF SE (DE) 2016-12-07 EP disclosed
US-9512093-B2 Process for manufacturing 4-propargylated amino-benzoxazinones BASF SE (DE) 2016-12-06 US disclosed
US-9512093-B2 Process for manufacturing 4-propargylated amino-benzoxazinones BASF SE (DE) 2016-12-06 US disclosed
WO-2012080239-A1 HERBICIDAL COMPOSITIONS BASF SE (DE) 2012-06-21 WO disclosed
US-20120100991-A1 HERBICIDAL BENZOXAZINONES BASF SE (DE) 2012-04-26 US disclosed
US-20120100991-A1 HERBICIDAL BENZOXAZINONES BASF SE (DE) 2012-04-26 US disclosed
US-20120100991-A1 HERBICIDAL BENZOXAZINONES BASF SE (DE) 2012-04-26 US disclosed
EP-2443102-A1 HERBICIDAL BENZOXAZINONES BASF SE (DE) 2012-04-25 EP disclosed
WO-2012041789-A1 HERBICIDAL BENZOXAZINONES BASF SE (DE) 2012-04-05 WO disclosed
WO-2012041789-A1 HERBICIDAL BENZOXAZINONES BASF SE (DE) 2012-04-05 WO disclosed
WO-2011057935-A1 3-(3,4-DIHYDRO-2H-BENZO [1,4]OXAZIN-6-YL)-1H-PYRIMIDIN-2,4-DIONE COMPOUNDS AS HERBICIDES BASF SE (DE) 2011-05-19 WO disclosed
WO-2011057935-A1 3-(3,4-DIHYDRO-2H-BENZO [1,4]OXAZIN-6-YL)-1H-PYRIMIDIN-2,4-DIONE COMPOUNDS AS HERBICIDES BASF SE (DE) 2011-05-19 WO disclosed
WO-2010145992-A1 HERBICIDAL BENZOXAZINONES BASF SE (DE) 2010-12-23 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 (1 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-20120100991-A1 HERBICIDAL BENZOXAZINONES CYP4X1, AOX1, PRDX5 PGR 2975/4885CYP19A1 38/4885ALDH1A1 237/4885

“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.