SCHEMBL6802667

SCHEMBL6802667

CCN(OC)C(=O)C(Cc1ccc([N+](=O)[O-])cc1)NC(=O)OC(C)(C)C

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.52
PPARA Q07869 1/20 0.52
CTSS P25774 6/20 0.43
CTSK P43235 5/20 0.43
ITGA4 P13612 1/20 0.43
ITGB7 P26010 1/20 0.43
CTSL P07711 1/20 0.42
CTSB P07858 1/20 0.42
ITGB3 P05106 1/20 0.41
ITGA2B P08514 1/20 0.41
ACE P12821 1/20 0.41
KLK5 Q9Y337 1/20 0.40
MMP1 P03956 1/20 0.40
MMP2 P08253 1/20 0.40
MMP9 P14780 1/20 0.40
MMP8 P22894 1/20 0.40
MMP13 P45452 1/20 0.40

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
SCHEMBL6917965 0.91 PPARG (0.51) PPARGPPARACTSSCTSKITGA4
SCHEMBL6594286 0.87 PPARG (0.53) PPARGPPARACTSSCTSKITGA4
SCHEMBL6804057 0.86 PPARG (0.56) PPARGPPARACTSSCTSKITGA4
SCHEMBL6804068 0.86 PPARG (0.56) PPARGPPARACTSSCTSKITGA4
SCHEMBL19212613 0.83 PPARG (0.58) PPARGPPARACTSSCTSKITGA4
SCHEMBL3319460 0.83 PPARG (0.58) PPARGPPARACTSSCTSKITGA4
SCHEMBL2728823 0.83 PPARG (0.58) PPARGPPARACTSSCTSKITGA4
SCHEMBL17083769 0.82 PPARG (0.57) PPARGPPARACTSSCTSKITGA4
SCHEMBL6674404 0.82 PPARG (0.59) PPARGPPARACTSSCTSKITGA4
SCHEMBL199415 0.82 PPARA (0.68) PPARGPPARACTSSCTSKITGA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040167183-A1 Phenethylamino sulfamic acids THE PROCTER & GAMBLE COMPANY 2004-08-26 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-20040167183-A1 Phenethylamino sulfamic acids PTPRM, PTPRS, PTPRE PPARG 1041/4885PPARA 1031/4885CTSS 1861/4885

“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.