SCHEMBL733528

SCHEMBL733528

COC(=O)c1ccc(C(F)(F)F)nc1S(=O)(=O)NC(=O)Nc1nc(OC)cc(OC)n1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.61
CDK1 P06493 1/20 0.49
TUBB4A P04350 1/20 0.43
TUBB P07437 1/20 0.43
TUBA3C P0DPH7 1/20 0.43
TUBA1B P68363 1/20 0.43
TUBA4A P68366 1/20 0.43
TUBB4B P68371 1/20 0.43
TUBB3 Q13509 1/20 0.43
TUBB2A Q13885 1/20 0.43
TUBB8 Q3ZCM7 1/20 0.43
TUBA3E Q6PEY2 1/20 0.43
TUBA1A Q71U36 1/20 0.43
TUBA1C Q9BQE3 1/20 0.43
TUBB6 Q9BUF5 1/20 0.43
TUBB2B Q9BVA1 1/20 0.43
TUBB1 Q9H4B7 1/20 0.43
TP53 P04637 1/20 0.41
GLA P06280 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL1535823 1.00 GAA (0.61) GAACDK1TUBB4ATUBBTUBA3C
SCHEMBL30116876 1.00 GAA (0.61) GAACDK1TUBB4ATUBBTUBA3C
SCHEMBL1535822 0.99 GAA (0.60) GAACDK1TUBB4ATUBBTUBA3C
Flupyrsulfuron SCHEMBL115535 0.92 GAA (0.61) GAACDK1TUBB4ATUBBTUBA3C
Flupyrsulfuron SCHEMBL9258976 0.91 GAA (0.60) GAACDK1TUBB4ATUBBTUBA3C
SCHEMBL6293994 0.90 GAA (0.49) GAACDK1TUBB4ATUBBTUBA3C
Flupyrsulfuron SCHEMBL1806123 0.90 GAA (0.59) GAACDK1TUBB4ATUBBTUBA3C
SCHEMBL6293992 0.89 GAA (0.48) GAACDK1TUBB4ATUBBTUBA3C
SCHEMBL10514535 0.86 GAA (0.52) GAACDK1TP53GLAMAPT
SCHEMBL27580543 0.86 TUBB4A (0.45) GAACDK1TUBB4ATUBBTUBA3C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4337017-A1 HERBICIDE/SAFENER COMBINATION BASED ON SAFENERS FROM THE CLASS OF SUBSTITUTED [(1,5-DIPHENYL-1H-1,2,4-TRIAZOL-3-YL)OXY]ACETIC ACIDS AND THEIR SALTS Bayer Aktiengesellschaft (DE) 2024-03-20 EP claimed
WO-2022152728-A1 HERBICIDAL COMPOSITIONS BAYER AKTIENGESELLSCHAFT (DE) 2022-07-21 WO claimed
EP-2243362-B1 Selective heteroaryloxy-acetamide-based herbicides BAYER CROPSCIENCE AG (DE) 2014-12-24 EP claimed
EP-1053679-B1 Herbicidal compositions BAYER CROPSCIENCE SA (FR) 2006-04-19 EP claimed
US-6967188-B2 Selective heteroaryloxy- acetamides-based herbicides BAYER CROPSCIENCE AG (DE) 2005-11-22 US claimed
EP-1221844-B1 SELECTIVE HERBICIDES BASED ON PYRIMIDINE-DERIVATIVES BAYER CROPSCIENCE AG (DE) 2004-08-18 EP claimed
US-20040102321-A1 Selective heteroaryloxy- acetamides-based herbicides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2004-05-27 US claimed
US-20010056040-A1 Controlling weeds; synergistic mixtures BAYER AKTIENGESELLSCHAFT KONZERNBEREICH RP PATENT UND LIZENZEN (DE) 2001-12-27 US claimed
EP-1053679-A1 Herbicidal compositions AVENTIS CROPSCIENCE S.A. (FR) 2000-11-22 EP claimed
EP-0647097-B1 DRY FLOWABLE AGRICULTURAL COMPOSITIONS OF GLYPHOSATE MADE WITHOUT DRYING OF THE FINAL PRODUCT DU PONT (US) 1998-11-11 EP claimed
US-5569639-A Dry flowable agricultural compositions of glyphosate and sulfonylurea herbicides made without drying of the final product E. I. DU PONT DE NEMOURS AND COMPANY (US) 1996-10-29 US claimed
US-5538936-A PESTICIDE, POLYELECTROLYTE, SURFACTANT, SUSPENDING AGENT IN AQUEOUS MEDIUM; THIXOTROPY E. I. DU PONT DE NEMOURS AND COMPANY (US) 1996-07-23 US claimed
WO-1996013977-A2 HERBICIDAL MIXTURES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1996-05-17 WO claimed
WO-1996003878-A1 HERBICIDAL MIXTURES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1996-02-15 WO claimed
EP-0683627-A1 EFFERVESCENT PESTICIDE TABLET WITH METAL PERBORATE E.I. DU PONT DE NEMOURS AND COMPANY (US) 1995-11-29 EP claimed
EP-0647097-A1 DRY FLOWABLE AGRICULTURAL COMPOSITIONS OF GLYPHOSATE MADE WITHOUT DRYING OF THE FINAL PRODUCT E.I. DU PONT DE NEMOURS AND COMPANY (US) 1995-04-12 EP claimed
EP-0626807-A1 METHOD FOR SPRAY TANK CLEANOUT E.I. DU PONT DE NEMOURS AND COMPANY (US) 1994-12-07 EP claimed
WO-1994017660-A1 EFFERVESCENT PESTICIDE TABLET WITH METAL PERBORATE E.I. DU PONT DE NEMOURS AND COMPANY (US) 1994-08-18 WO claimed
WO-1993025081-A1 DRY FLOWABLE AGRICULTURAL COMPOSITIONS OF GLYPHOSATE MADE WITHOUT DRYING OF THE FINAL PRODUCT E.I. DU PONT DE NEMOURS AND COMPANY (US) 1993-12-23 WO claimed
WO-1993016596-A1 METHOD FOR SPRAY TANK CLEANOUT E.I. DU PONT DE NEMOURS AND COMPANY (US) 1993-09-02 WO claimed

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-20040102321-A1 Selective heteroaryloxy- acetamides-based herbicides AADAC, HACL2, HDHD5 GAA 91/4885CDK1 3875/4885TUBB4A 1702/4885
US-20010056040-A1 Controlling weeds; synergistic mixtures AS3MT, OSR1, MSRB3 GAA 2638/4885CDK1 2606/4885TUBB4A 1851/4885

“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.