SCHEMBL5847237

SCHEMBL5847237

CCC(=O)N(C)c1ccc(C(=O)OC)c(S(=O)(=O)NC(=O)Nc2nc(OC)cc(OC)n2)c1.[Na]

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 1/20 0.54
GAA P10253 1/20 0.50
MAPT P10636 2/20 0.39
TP53 P04637 1/20 0.39
GLA P06280 1/20 0.39
CYP1A2 P05177 1/20 0.36
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL5847235 0.98 CDK1 (0.54) CDK1GAAMAPTTP53GLA
SCHEMBL9080269 0.85 CDK1 (0.62) CDK1GAAMAPTTP53GLA
SCHEMBL8664968 0.83 CDK1 (0.51) CDK1GAAMAPTTP53GLA
SCHEMBL9202913 0.83 CDK1 (0.55) CDK1GAAMAPTTP53GLA
SCHEMBL9197645 0.83 CDK1 (0.55) CDK1GAAMAPTTP53GLA
SCHEMBL7877906 0.81 CDK1 (0.50) CDK1GAAMAPTTP53GLA
SCHEMBL11385667 0.80 CDK1 (0.57) CDK1GAAMAPTTP53GLA
SCHEMBL8507050 0.79 CDK1 (0.56) CDK1GAAMAPTTP53GLA
SCHEMBL10395502 0.79 CDK1 (0.56) CDK1GAAMAPTTP53GLA
SCHEMBL8780855 0.79 GAA (0.51) CDK1GAAMAPTTP53GLA

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060148647-A1 Combinations of phenylsulfonylurea herbicides and safeners BAYER INTELLECTUAL PROPERTY GMBH (DE) 2006-07-06 US claimed
US-20040157737-A1 For protecting crop plants from phytotoxic side effects of herbicides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2004-08-12 US claimed
US-6743754-B2 A SULFONYLUREA AND ONE OR MORE SURFACTANTS COMPRISING AS STRUCTURAL ELEMENT AT LEAST 10 ALKYLENE OXIDE UNITS. AVENTIS CROPSCIENCE GMBH (DE) 2004-06-01 US claimed
US-8901036-B2 Combinations of phenylsulfonylurea herbicides and safeners BAYER CROPSCIENCE AG (DE) 2014-12-02 US disclosed
US-7141531-B2 For protecting crop plants from phytotoxic side effects of herbicides HOECHST SCHERING AGREVO GMBH (DE) 2006-11-28 US disclosed
US-20060148647-A1 Combinations of phenylsulfonylurea herbicides and safeners BAYER INTELLECTUAL PROPERTY GMBH (DE) 2006-07-06 US disclosed
US-20040157737-A1 For protecting crop plants from phytotoxic side effects of herbicides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2004-08-12 US disclosed
US-6743754-B2 A SULFONYLUREA AND ONE OR MORE SURFACTANTS COMPRISING AS STRUCTURAL ELEMENT AT LEAST 10 ALKYLENE OXIDE UNITS. AVENTIS CROPSCIENCE GMBH (DE) 2004-06-01 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-20060148647-A1 Combinations of phenylsulfonylurea herbicides and safeners QSOX1, CYP2W1, SULT2A1 CDK1 888/4885GAA 2124/4885MAPT 4802/4885
US-20040157737-A1 For protecting crop plants from phytotoxic side effects of herbicides GSTO1, CYP1A1, HAO2 CDK1 2095/4885GAA 1201/4885MAPT 4392/4885

“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.