SCHEMBL939859

SCHEMBL939859

COc1cc(OC)nc(NC(=O)NS(=O)(=O)c2ncccc2C2=NOCCO2)n1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.47
CDK1 P06493 1/20 0.39
MAPT P10636 2/20 0.37
KMT2A Q03164 2/20 0.37
TP53 P04637 1/20 0.37
GLA P06280 1/20 0.37
CYP1A2 P05177 1/20 0.36
NLRP3 Q96P20 1/20 0.32
MEN1 O00255 1/20 0.32
USP2 O75604 1/20 0.32

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
Ammonia Solution, Strong SCHEMBL939852 0.99 GAA (0.46) GAACDK1MAPTKMT2ATP53
Isopropylamine SCHEMBL939850 0.96 GAA (0.43) GAACDK1MAPTKMT2ATP53
SCHEMBL4582813 0.95 GAA (0.42) GAACDK1MAPTKMT2ATP53
SCHEMBL15244182 0.95 GAA (0.42) GAACDK1MAPTKMT2ATP53
Monoethanolamine SCHEMBL940690 0.94 GAA (0.42) GAACDK1MAPTKMT2ATP53
Diethanolamine SCHEMBL971552 0.93 GAA (0.42) GAACDK1MAPTKMT2ATP53
Trolamine SCHEMBL1009951 0.93 GAA (0.42) GAACDK1MAPTKMT2ATP53
SCHEMBL15695214 0.93 GAA (0.40) GAACDK1MAPTKMT2ATP53
SCHEMBL15499805 0.93 GAA (0.40) GAACDK1MAPTKMT2ATP53
SCHEMBL15805494 0.88 GAA (0.40) GAAKMT2ATP53MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110009263-A1 SELECTED SALTS OF 3-(5,6-DIHYDRO-1,4,2-DIOXAZIN-3-YL)-N-[(4,6-DIMETHOXYPYRIMIDIN-2-YL)CARBAMOYL]PYRIDINE-2-SULFONAMIDE, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF AS HERBICIDES AND PLANT GROWTH REGULATORS BAYER CROPSCIENCE AG (DE) 2011-01-13 US claimed
EP-2265121-A1 SELECTED SALTS OF 3-(5,6-DIHYDRO-1,4,2-DIOXAZINE-3-YL)-N-[(4,6- DIMETHOXYPYRIMIDINE-2-YL)CARBAMOYL]PYRIDINE-2-SULFONAMIDE, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF AS HERBICIDES AND PLANT GROWTH REGULATORS Bayer CropScience AG (DE) 2010-12-29 EP claimed
WO-2009115237-A1 SELECTED SALTS OF 3-(5,6-DIHYDRO-1,4,2-DIOXAZINE-3-YL)-N-[(4,6- DIMETHOXYPYRIMIDINE-2-YL)CARBAMOYL]PYRIDINE-2-SULFONAMIDE, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF AS HERBICIDES AND PLANT GROWTH REGULATORS BAYER CROPSCIENCE AG (DE) 2009-09-24 WO claimed
EP-2103216-A1 Selected salts from 3-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl] pyridine-2-sulfonamide, methods for their production and their usage as herbicides and plant growth regulators Bayer CropScience AG (DE) 2009-09-23 EP claimed
US-10544426-B2 Methods of using ALS inhibitor herbicides for control of unwanted vegetation in ALS inhibitor herbicide tolerant beta vulgaris plants BAYER INTELLECTUAL PROPERTY GMBH (DE) 2020-01-28 US disclosed
EP-3284346-A1 USE OF ALS INHIBITOR HERBICIDES FOR CONTROL OF UNWANTED VEGETATION IN ALS INHIBITOR HERBICIDE TOLERANT BETA VULGARIS PLANTS Bayer Intellectual Property GmbH (DE) 2018-02-21 EP disclosed
US-9686994-B2 Use of ALS inhibitor herbicides for control of unwanted vegetation in ALS inhibitor herbicide tolerant beta vulgaris plants BAYER CROPSCIENCE AG (DE) 2017-06-27 US disclosed
US-9686994-B2 Use of ALS inhibitor herbicides for control of unwanted vegetation in ALS inhibitor herbicide tolerant beta vulgaris plants BAYER CROPSCIENCE AG (DE) 2017-06-27 US disclosed
US-9572315-B2 ALS inhibitor herbicide tolerant B. napus mutants BAYER INTELLECTUAL PROPERTY GMBH (DE) 2017-02-21 US disclosed
US-9572315-B2 ALS inhibitor herbicide tolerant B. napus mutants BAYER INTELLECTUAL PROPERTY GMBH (DE) 2017-02-21 US disclosed
US-9370183-B2 Use of ALS inhibitor herbicides for control of unwanted vegetation in ALS inhibitor herbicide tolerant Brassica, such as B. napus, plants BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-06-21 US disclosed
US-9370183-B2 Use of ALS inhibitor herbicides for control of unwanted vegetation in ALS inhibitor herbicide tolerant Brassica, such as B. napus, plants BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-06-21 US disclosed
WO-2009115237-A1 SELECTED SALTS OF 3-(5,6-DIHYDRO-1,4,2-DIOXAZINE-3-YL)-N-[(4,6- DIMETHOXYPYRIMIDINE-2-YL)CARBAMOYL]PYRIDINE-2-SULFONAMIDE, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF AS HERBICIDES AND PLANT GROWTH REGULATORS BAYER CROPSCIENCE AG (DE) 2009-09-24 WO disclosed
EP-2103216-A1 Selected salts from 3-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl] pyridine-2-sulfonamide, methods for their production and their usage as herbicides and plant growth regulators Bayer CropScience AG (DE) 2009-09-23 EP disclosed
EP-2103216-A1 Selected salts from 3-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl] pyridine-2-sulfonamide, methods for their production and their usage as herbicides and plant growth regulators Bayer CropScience AG (DE) 2009-09-23 EP disclosed
EP-2103216-A1 Selected salts from 3-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl] pyridine-2-sulfonamide, methods for their production and their usage as herbicides and plant growth regulators Bayer CropScience AG (DE) 2009-09-23 EP disclosed
EP-2103216-A1 Selected salts from 3-(5,6-dihydro-1,4,2-dioxazin-3-yl)-N-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl] pyridine-2-sulfonamide, methods for their production and their usage as herbicides and plant growth regulators Bayer CropScience AG (DE) 2009-09-23 EP disclosed
US-20090088513-A1 RESIN ADDITIVE COMPOSITION AND RESIN COMPOSITION ADEKA CORPORATION (JP) 2009-04-02 US disclosed
EP-1897914-A1 RESIN ADDITIVE COMPOSITION AND RESIN COMPOSITION Adeka Corporation (JP) 2008-03-12 EP disclosed
US-6103828-A A BLENDS COMPRISING THERMOPLASTIC RESINS, THERMOSETTING RESINS AND RUBBERS, AND A POLYVINYL CYCLOHEXANE RESIN OR ACOMPOUND HAVING HYDROINDANE AS VISCOSITY MODIFIER; IMPROVES MELT FLOW, FLEXIBILITY AT A LOW TEMPERATURE, BENDING STRENGTH HITACHI CHEMICAL CO. LTD. (JP) 2000-08-15 US 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-20110009263-A1 SELECTED SALTS OF 3-(5,6-DIHYDRO-1,4,2-DIOXAZIN-3-YL)-N-[(4,6-DIMETHOXYPYRIMIDIN-2-YL)CARBAMOYL]PYRIDINE-2-SULFONAMIDE, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF AS HERBICIDES AND PLANT GROWTH REGULATORS DDT, DYRK4, SLTM GAA 1122/4885CDK1 662/4885MAPT 3826/4885
US-10544426-B2 Methods of using ALS inhibitor herbicides for control of unwanted vegetation in ALS inhibitor herbicide tolerant beta vulgaris plants LCT, HTT, GLO1 GAA 32/4885CDK1 2823/4885MAPT 50/4885

“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.