SCHEMBL2207641

SCHEMBL2207641

COc1[c]c(OS(=O)(=O)c2ccc(C)cc2)ccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
ESR1 P03372 1/20 0.46
ESR2 Q92731 1/20 0.46
KEAP1 Q14145 1/20 0.43
NFE2L2 Q16236 1/20 0.43
LMNA P02545 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
HTT P42858 2/20 0.42
ALDH1A1 P00352 2/20 0.42
MAPT P10636 1/20 0.42
TUBB4A P04350 1/20 0.42
TUBB P07437 1/20 0.42
TUBA3C P0DPH7 1/20 0.42
TUBA1B P68363 1/20 0.42
TUBA4A P68366 1/20 0.42
TUBB4B P68371 1/20 0.42
TUBB3 Q13509 1/20 0.42
TUBB2A Q13885 1/20 0.42

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
SCHEMBL8820285 0.80 MEN1 (0.55) GAAMEN1KMT2AESR1ESR2
SCHEMBL6935683 0.78 KMT2A (0.51) GAAMEN1KMT2AESR1ESR2
SCHEMBL64533 0.76 KMT2A (0.62) GAAMEN1KMT2AESR1ESR2
SCHEMBL24442 0.75 CA1 (0.31) NFE2L2LMNASMN1; SMN2ALDH1A1MAPT
SCHEMBL23728 0.75 KEAP1 (0.48) GAAMEN1KMT2AESR1ESR2
SCHEMBL18263184 0.75 ALDH1A1 (0.51) GAAMEN1KMT2AESR1ESR2
SCHEMBL8055604 0.75 MEN1 (0.65) GAAMEN1KMT2AESR1ESR2
SCHEMBL31233614 0.75 GAA (0.49) GAAMEN1KMT2AESR1ESR2
SCHEMBL2973941 0.72 GAA (0.47) GAAMEN1KMT2AESR1ESR2
SCHEMBL8378270 0.72 MEN1 (0.50) GAAMEN1KMT2AESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070015918-A1 Derivatives of 1,3-diones having a herbicidal activity ISAGRO RICERCA S.R.L (IT) 2007-01-18 US claimed
US-7982047-B2 Derivatives of 1,3-diones having a herbicidal activity ISAGRO RICERCA S.R.L. (IT) 2011-07-19 US disclosed
US-20070015918-A1 Derivatives of 1,3-diones having a herbicidal activity ISAGRO RICERCA S.R.L (IT) 2007-01-18 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-20070015918-A1 Derivatives of 1,3-diones having a herbicidal activity DDT, CYP1B1, CYP51A1 GAA 121/4885MEN1 4522/4885KMT2A 1573/4885

“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.