SCHEMBL10035239

SCHEMBL10035239

CCOCCNc1c(S(C)(=O)=O)ccc(C(=O)c2c(C)nn(C)c2O)c1Cl

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 2/20 0.31
ALDH1A1 P00352 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL10035238 0.91
SCHEMBL10035235 0.90 ABCB1 (0.35) ALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL10035246 0.87 NR3C1 (0.36) NR3C1ALDH1A1SMN1; SMN2
SCHEMBL12602575 0.83 ALDH1A1 (0.33) ALDH1A1L3MBTL1
SCHEMBL10035233 0.82 ALDH1A1 (0.33) NR3C1ALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL20065811 0.82 SMN1; SMN2 (0.31) NR3C1SMN1; SMN2
SCHEMBL10035242 0.81 CRHR1 (0.33)
SCHEMBL4584263 0.81 NR3C1 (0.34) NR3C1ALDH1A1L3MBTL1
SCHEMBL10035237 0.80 ALDH1A1 (0.34) NR3C1ALDH1A1SMN1; SMN2
SCHEMBL10035234 0.80 ABCB1 (0.36) SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8178695-B2 Applying to unwanted plants or weeds; controlling broadleaf plants BAYER CROPSCIENCE AG (DE) 2012-05-15 US disclosed
US-20080254990-A1 4-(3-Aminobenzoyl)-1,3-dimethylpyrazoles and their use as herbicides BAYER CROPSCIENCE AG (DE) 2008-10-16 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 (1 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-20080254990-A1 4-(3-Aminobenzoyl)-1,3-dimethylpyrazoles and their use as herbicides DDT, TH, ABAT NR3C1 1717/4885ALDH1A1 135/4885L3MBTL1 455/4885

“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.