SCHEMBL167829

SCHEMBL167829

C=CCOC(=O)C(Oc1ccc(Cl)c2cccnc12)C(=O)OCC=C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.52
ALOX12 P18054 3/20 0.52
TDP1 Q9NUW8 2/20 0.52
CYP3A4 P08684 1/20 0.52
PKM P14618 1/20 0.50
GAA P10253 2/20 0.49
NPSR1 Q6W5P4 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
HTT P42858 1/20 0.47
MAPT P10636 6/20 0.47
L3MBTL1 Q9Y468 4/20 0.46
HSP90AA1 P07900 3/20 0.46
CCR6 P51684 2/20 0.46
KMT2A Q03164 4/20 0.46
ALDH1A1 P00352 3/20 0.46
MEN1 O00255 3/20 0.46
HSD17B10 Q99714 2/20 0.46
MAPK1 P28482 1/20 0.46
HPGD P15428 1/20 0.44
TSHR P16473 1/20 0.44

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
SCHEMBL343027 0.85 TSHR (0.36) KDM4EALOX12TDP1CYP3A4PKM
SCHEMBL30050527 0.84 KDM4E (0.59) KDM4EALOX12TDP1CYP3A4PKM
SCHEMBL167490 0.84 KDM4E (0.59) KDM4EALOX12TDP1CYP3A4PKM
SCHEMBL4902562 0.82 PKM (0.60) KDM4EALOX12TDP1CYP3A4PKM
SCHEMBL30158490 0.82 PKM (0.60) KDM4EALOX12TDP1CYP3A4PKM
SCHEMBL571588 0.81 KDM4E (0.52) KDM4EALOX12TDP1CYP3A4PKM
SCHEMBL6899249 0.81 KDM4E (0.45) KDM4EALOX12TDP1CYP3A4PKM
SCHEMBL22129254 0.81 KDM4E (0.47) KDM4EALOX12TDP1CYP3A4PKM
SCHEMBL9065818 0.81 PKM (0.58) KDM4EALOX12TDP1CYP3A4PKM
SCHEMBL168649 0.81 KDM4E (0.57) KDM4EALOX12TDP1CYP3A4PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011138280-A2 HERBICIDE/SAFENER COMBINATIONS COMPRISING ARYLPYRIDAZINONES AND SAFENER BAYER CROPSCIENCE AG (DE) 2011-11-10 WO claimed
EP-2210492-A1 Herbicide safener combination Bayer CropScience AG (DE) 2010-07-28 EP claimed
EP-2191720-A1 Herbicide-safener combination Bayer CropScience AG (DE) 2010-06-02 EP claimed
EP-2191719-A1 Herbicide safener combination Bayer CropScience AG (DE) 2010-06-02 EP claimed
EP-2191716-A1 Herbicide safener combination Bayer CropScience AG (DE) 2010-06-02 EP claimed
US-7115543-B2 Aryl sulfonyl amino carbonyl triazole based selective herbicides BAYER CROPSCIENCE AG (DE) 2006-10-03 US claimed
US-20060160703-A1 Selective herbicides based on substituted cyclic dicarbonyl compounds and safeners BAYER CROPSCIENCE AG (DE) 2006-07-20 US claimed
EP-1303189-B1 ARYL SULFONYL AMINO CARBONYL TRIAZOLE BASED SELECTIVE HERBICIDES BAYER CROPSCIENCE AG (DE) 2005-08-24 EP claimed
EP-1561378-A2 Selective herbicides based upon arylsulfonylaminocarbonyltriazolinones Bayer CropScience AG (DE) 2005-08-10 EP claimed
US-20050009705-A1 Selective herbicides based on substituted thien-3-yl-sulfonylamino(thio)carbonyltriazolin(thi)ones and safeners BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2005-01-13 US claimed
US-20040132619-A1 Selective substituted aryl ketone and safener based herbicides BAYER CROPSCIENCE K.K. (JP) 2004-07-08 US claimed
EP-1429613-A1 SELECTIVE HERBICIDES BASED ON SUBSTITUTED THIEN-3-YL-SULFONYLAMINO(THIO)CARBONYL-TRIAZOLIN(THI)ONES AND SAFENERS Bayer CropScience AG (DE) 2004-06-23 EP claimed
US-20040048887-A1 Pharmaceutical compositions based on anticholinergics and EGFR kinase inhibitors BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-03-11 US claimed
US-20030211942-A1 Aryl sulfonyl amino carbonyl triazole based selective herbicides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2003-11-13 US claimed
WO-2003026427-A1 SELECTIVE HERBICIDES BASED ON SUBSTITUTED THIEN-3-YL-SULFONYLAMINO(THIO)CARBONYL-TRIAZOLIN(THI)ONES AND SAFENERS BAYER CROPSCIENCE AG (DE) 2003-04-03 WO claimed
US-20260138958-A1 SUBSTITUTED N-PHENYLURACILS AND SALTS THEREOF, AND USE THEREOF AS HERBICIDAL ACTIVE SUBSTANCES BAYER AG (DE) 2026-05-21 US disclosed
US-12599136-B2 Substituted isophthalic acid diamides and their use as herbicides BAYER AKTIENGESELLSCHAFT (DE) 2026-04-14 US disclosed
EP-0721299-A1 NEW MIXTURES OF HERBICIDES AND ANTIDOTES Hoechst Schering AgrEvo GmbH (DE) 1996-07-17 EP disclosed
WO-1996014747-A1 COMBINATIONS OF PHENYLSULPHONYL UREA HERBICIDES AND SAFENERS HOECHST SCHERING AGREVO GMBH (DE) 1996-05-23 WO disclosed
WO-1995008919-A1 NEW MIXTURES OF HERBICIDES AND ANTIDOTES HOECHST SCHERING AGREVO GMBH (DE) 1995-04-06 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 (7 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-20260138958-A1 SUBSTITUTED N-PHENYLURACILS AND SALTS THEREOF, AND USE THEREOF AS HERBICIDAL ACTIVE SUBSTANCES CBR1, CBR3, HDHD5 KDM4E 3156/4885ALOX12 3049/4885TDP1 2149/4885
US-20030211942-A1 Aryl sulfonyl amino carbonyl triazole based selective herbicides AADAC, CBR3, ABAT KDM4E 1867/4885ALOX12 2886/4885TDP1 2397/4885
US-20040132619-A1 Selective substituted aryl ketone and safener based herbicides CYP2W1, CYP4Z1, CYP2E1 KDM4E 1001/4885ALOX12 1017/4885TDP1 2051/4885
US-20050009705-A1 Selective herbicides based on substituted thien-3-yl-sulfonylamino(thio)carbonyltriazolin(thi)ones and safeners TARS2, TST, DDT KDM4E 2555/4885ALOX12 3169/4885TDP1 141/4885
US-20060160703-A1 Selective herbicides based on substituted cyclic dicarbonyl compounds and safeners DDT, DDX41, DDC KDM4E 627/4885ALOX12 3144/4885TDP1 775/4885
US-12599136-B2 Substituted isophthalic acid diamides and their use as herbicides P4HA1, DDT, CNPY2 KDM4E 2659/4885ALOX12 2822/4885TDP1 237/4885
US-20040048887-A1 Pharmaceutical compositions based on anticholinergics and EGFR kinase inhibitors CHRM3, EGFR, ERBB2 KDM4E 3953/4885ALOX12 3639/4885TDP1 3031/4885

“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.