SCHEMBL281864

SCHEMBL281864

O=C(Nc1ccc(O)cc1)Nc1ccc(Cl)c(C(F)(F)F)c1

nearest known ligand 0.85

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDR P35968 3/20 0.85
TRPV1 Q8NER1 11/20 0.78
CA1 P00915 4/20 0.69
CA2 P00918 4/20 0.69
CA7 P43166 4/20 0.69
CA9 Q16790 4/20 0.69
HDAC1 Q13547 1/20 0.64
HDAC8 Q9BY41 1/20 0.64
HDAC6 Q9UBN7 1/20 0.64
PDK1 Q15118 1/20 0.62
CDK8 P49336 1/20 0.58

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
SCHEMBL118026 0.92 KDR (1.00) KDRTRPV1CA1CA2CA7
SCHEMBL29364392 0.92 KDR (1.00) KDRTRPV1CA1CA2CA7
Cloflucarban SCHEMBL27537485 0.89 KDR (0.88) KDRTRPV1CA1CA2CA7
Cloflucarban SCHEMBL119821 0.89 KDR (0.88) KDRTRPV1CA1CA2CA7
SCHEMBL16884950 0.88 KDR (0.85) KDRTRPV1CA1CA2CA7
SCHEMBL18615348 0.88 KDR (0.85) KDRTRPV1CA1CA2CA7
SCHEMBL11005015 0.88 KDR (0.85) KDRTRPV1CA1CA2CA7
SCHEMBL9084296 0.88 KDR (0.85) KDRTRPV1CA1CA2CA7
SCHEMBL4548158 0.88 KDR (0.90) KDRTRPV1CA1CA2CA7
SCHEMBL26697308 0.88 KDR (0.74) KDRTRPV1CA1CA2CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3590941-B1 UREA-SUBSTITUTED AROMATIC RING-LINKED DIOXANE-QUINAZOLINE AND -LINKED DIOXANE-QUINOLINE COMPOUNDS, PREPARATION METHOD THEREFOR AND USE THEREOF BEIJING SCITECH MQ PHARMACEUTICALS LTD (CN) 2023-11-22 EP disclosed
EP-3590941-B1 UREA-SUBSTITUTED AROMATIC RING-LINKED DIOXANE-QUINAZOLINE AND -LINKED DIOXANE-QUINOLINE COMPOUNDS, PREPARATION METHOD THEREFOR AND USE THEREOF BEIJING SCITECH MQ PHARMACEUTICALS LTD (CN) 2023-11-22 EP disclosed
US-10980809-B2 Urea-substituted aromatic ring-linked dioxane-quinazoline and -linked dioxane-quinoline compounds, preparation method therefor and use thereof BEIJING SCITECH-MQ PHARMACEUTICALS LIMITED (CN) 2021-04-20 US disclosed
US-10980809-B2 Urea-substituted aromatic ring-linked dioxane-quinazoline and -linked dioxane-quinoline compounds, preparation method therefor and use thereof BEIJING SCITECH-MQ PHARMACEUTICALS LIMITED (CN) 2021-04-20 US disclosed
CN-108530455-B Urea substituted aromatic ring connecting dioxane and quinazoline compound or medicinal salt or hydrate and application as tyrosine kinase inhibitor 北京赛特明强医药科技有限公司 2021-01-12 CN disclosed
US-20200061065-A1 UREA-SUBSTITUTED AROMATIC RING-LINKED DIOXANE-QUINAZOLINE AND -LINKED DIOXANE-QUINOLINE COMPOUNDS, PREPARATION METHOD THEREFOR AND USE THEREOF BEIJING SCITECH-MQ PHARMACEUTICALS LIMITED (CN) 2020-02-27 US disclosed
US-20200061065-A1 UREA-SUBSTITUTED AROMATIC RING-LINKED DIOXANE-QUINAZOLINE AND -LINKED DIOXANE-QUINOLINE COMPOUNDS, PREPARATION METHOD THEREFOR AND USE THEREOF BEIJING SCITECH-MQ PHARMACEUTICALS LIMITED (CN) 2020-02-27 US disclosed
CN-108586330-A A kind of preparation method and applications of tumor 日照市普达医药科技有限公司 2018-09-28 CN disclosed
CN-108530455-A Aromatic ring Lian dioxanes simultaneously quinazoline compounds or pharmaceutical salts or hydrate and the application as tyrosine kinase inhibitor of urea substitution 北京赛特明强医药科技有限公司 2018-09-14 CN disclosed
EP-3330254-A2 METHOD AND PROCESS FOR PREPARATION AND PRODUCTION OF DEUTERATED OMEGA-DIPHENYLUREA Suzhou Zelgen Biopharmaceutical Co., Ltd. (CN) 2018-06-06 EP disclosed
US-20100311980-A1 Process for the Preparation of a RAF Kinase Inhibitor and Intermediates for Use in the Process CIPLA LIMITED (IN) 2010-12-09 US disclosed
US-20100311980-A1 Process for the Preparation of a RAF Kinase Inhibitor and Intermediates for Use in the Process CIPLA LIMITED (IN) 2010-12-09 US disclosed
EP-2220042-A1 NOVEL BIFUNCTIONAL COMPOUNDS WHICH INHIBIT PROTEIN KINASES AND HISTONE DEACETYLASES 4SC AG (DE) 2010-08-25 EP disclosed
EP-2195286-A2 PROCESS FOR THE PREPARATION OF A RAF KINASE INHIBITOR AND INTERMEDIATES FOR USE IN THE PROCESS Cipla Limited (IN) 2010-06-16 EP disclosed
WO-2009063054-A1 NOVEL BIFUNCTIONAL COMPOUNDS WHICH INHIBIT PROTEIN KINASES AND HISTONE DEACETYLASES 4SC AG (DE) 2009-05-22 WO disclosed
EP-2060565-A1 Novel bifunctional compounds which inhibit protein kinases and histone deacetylases 4SC AG (DE) 2009-05-20 EP disclosed
WO-2009054004-A2 PROCESS FOR THE PREPARATION OF SORAFENIB NATCO PHARMA LIMITED (IN) 2009-04-30 WO disclosed
WO-2009054004-A2 PROCESS FOR THE PREPARATION OF SORAFENIB NATCO PHARMA LIMITED (IN) 2009-04-30 WO disclosed
WO-2009034308-A2 PROCESS FOR THE PREPARATION OF A RAF KINASE INHIBITOR AND INTERMEDIATES FOR USE IN THE PROCESS CIPLA LIMITED (IN) 2009-03-19 WO disclosed
WO-2009034308-A2 PROCESS FOR THE PREPARATION OF A RAF KINASE INHIBITOR AND INTERMEDIATES FOR USE IN THE PROCESS CIPLA LIMITED (IN) 2009-03-19 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 (3 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-20200061065-A1 UREA-SUBSTITUTED AROMATIC RING-LINKED DIOXANE-QUINAZOLINE AND -LINKED DIOXANE-QUINOLINE COMPOUNDS, PREPARATION METHOD THEREFOR AND USE THEREOF BRAF, RAF1, ARAF KDR 5/4885TRPV1 2906/4885CA1 2792/4885
US-10980809-B2 Urea-substituted aromatic ring-linked dioxane-quinazoline and -linked dioxane-quinoline compounds, preparation method therefor and use thereof BRAF, RAF1, ARAF KDR 5/4885TRPV1 2906/4885CA1 2792/4885
US-20100311980-A1 Process for the Preparation of a RAF Kinase Inhibitor and Intermediates for Use in the Process BRAF, RAF1, ARAF KDR 272/4885TRPV1 2007/4885CA1 431/4885

“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.