SCHEMBL1898467

SCHEMBL1898467

CCc1cc(Cl)cc(OC)c1C1=C(O)C2(CCC(OC)CC2)NC1=O

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACACB O00763 13/20 0.51
ACACA Q13085 13/20 0.51
CDK4 P11802 1/20 0.33
CCND1 P24385 1/20 0.33
GSK3B P49841 1/20 0.33
BACE1 P56817 2/20 0.31
DPP4 P27487 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL14372081 0.92 ACACB (0.52) ACACBACACABACE1DPP4
SCHEMBL14372083 0.92 ACACB (0.52) ACACBACACABACE1DPP4
SCHEMBL3684010 0.92 ACACB (0.47) ACACBACACABACE1DPP4
SCHEMBL1899703 0.92 ACACB (0.47) ACACBACACABACE1DPP4
SCHEMBL13960143 0.91 ACACB (0.45) ACACBACACACDK4CCND1GSK3B
SCHEMBL12724985 0.91 ACACB (0.46) ACACBACACACDK4CCND1GSK3B
SCHEMBL13070822 0.90 ACACB (0.48) ACACBACACACDK4CCND1GSK3B
SCHEMBL13071298 0.90 ACACB (0.46) ACACBACACACDK4CCND1GSK3B
SCHEMBL12858783 0.88 ACACB (0.45) ACACBACACABACE1
SCHEMBL12022351 0.87 ACACB (0.57) ACACBACACACDK4CCND1GSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2320735-A2 HERBICIDAL COMBINATION WITH DIMETHOXY-TRIAZINYL-SUBSTITUTED DIFLUOROMETHANE SULFONYLANILIDES Bayer CropScience AG (DE) 2011-05-18 EP claimed
US-20100304971-A1 HERBICIDAL COMBINATION BAYER CROPSCIENCE AG (DE) 2010-12-02 US claimed
EP-2205092-A2 HERBICIDAL COMBINATION Bayer CropScience AG (DE) 2010-07-14 EP claimed
US-20100093542-A1 HERBICIDE COMBINATION COMPRISING DIMETHOXYTRIAZINYL SUBSTITUTED DIFLUOROMETHANESULFONYLANILIDES BAYER CORPSCIENCE AG (DE) 2010-04-15 US claimed
WO-2010017923-A2 HERBICIDAL COMBINATION WITH DIMETHOXY-TRIAZINYL-SUBSTITUTED DIFLUOROMETHANE SULFONYLANILIDES BAYER CROPSCIENCE AG (DE) 2010-02-18 WO claimed
WO-2009053053-A2 HERBICIDAL COMBINATION BAYER CROPSCIENCE AG (DE) 2009-04-30 WO claimed
CN-102186348-A Herbicidal combination comprising dimethoxytriazinyl-substituted difluoromethanesulfonylanilines BAYER CROPSCIENCE AG 2011-09-14 CN disclosed
EP-2320735-A2 HERBICIDAL COMBINATION WITH DIMETHOXY-TRIAZINYL-SUBSTITUTED DIFLUOROMETHANE SULFONYLANILIDES Bayer CropScience AG (DE) 2011-05-18 EP disclosed
EP-2320735-A2 HERBICIDAL COMBINATION WITH DIMETHOXY-TRIAZINYL-SUBSTITUTED DIFLUOROMETHANE SULFONYLANILIDES Bayer CropScience AG (DE) 2011-05-18 EP disclosed
WO-2010017923-A3 HERBICIDAL COMBINATION WITH DIMETHOXY-TRIAZINYL-SUBSTITUTED DIFLUOROMETHANE SULFONYLANILIDES BAYER CROPSCIENCE AG (DE) 2010-11-04 WO disclosed
EP-2205092-A2 HERBICIDAL COMBINATION Bayer CropScience AG (DE) 2010-07-14 EP disclosed
EP-2205092-A2 HERBICIDAL COMBINATION Bayer CropScience AG (DE) 2010-07-14 EP disclosed
WO-2009053053-A3 HERBICIDAL COMBINATION BAYER CROPSCIENCE AG (DE) 2010-05-20 WO disclosed
US-20100093542-A1 HERBICIDE COMBINATION COMPRISING DIMETHOXYTRIAZINYL SUBSTITUTED DIFLUOROMETHANESULFONYLANILIDES BAYER CORPSCIENCE AG (DE) 2010-04-15 US disclosed
WO-2010017923-A2 HERBICIDAL COMBINATION WITH DIMETHOXY-TRIAZINYL-SUBSTITUTED DIFLUOROMETHANE SULFONYLANILIDES BAYER CROPSCIENCE AG (DE) 2010-02-18 WO disclosed
WO-2010017923-A2 HERBICIDAL COMBINATION WITH DIMETHOXY-TRIAZINYL-SUBSTITUTED DIFLUOROMETHANE SULFONYLANILIDES BAYER CROPSCIENCE AG (DE) 2010-02-18 WO disclosed
WO-2009053053-A2 HERBICIDAL COMBINATION BAYER CROPSCIENCE AG (DE) 2009-04-30 WO disclosed
WO-2009053053-A2 HERBICIDAL COMBINATION BAYER CROPSCIENCE AG (DE) 2009-04-30 WO disclosed
US-20080167188-A1 Herbicide Combinations Comprising Special Ketoenoles BAYER CROPSCIENCE AG (DE) 2008-07-10 US disclosed
US-20080167188-A1 Herbicide Combinations Comprising Special Ketoenoles BAYER CROPSCIENCE AG (DE) 2008-07-10 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 (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-20080167188-A1 Herbicide Combinations Comprising Special Ketoenoles DDT, NOTUM, CA3 ACACB 190/4885ACACA 396/4885CDK4 1161/4885
US-20100093542-A1 HERBICIDE COMBINATION COMPRISING DIMETHOXYTRIAZINYL SUBSTITUTED DIFLUOROMETHANESULFONYLANILIDES DDT, B2M, THRB ACACB 2594/4885ACACA 3582/4885CDK4 749/4885
US-20100304971-A1 HERBICIDAL COMBINATION DDT, AADAC, CYP1B1 ACACB 650/4885ACACA 1187/4885CDK4 449/4885

“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.