SCHEMBL6801648

SCHEMBL6801648

Cc1ccc(S(=O)(=O)N(CCc2ccc([N+](=O)[O-])cc2)CC(=O)O)cc1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 6/20 0.61
MMP2 P08253 6/20 0.61
MMP9 P14780 6/20 0.61
MMP8 P22894 6/20 0.61
MMP13 P45452 6/20 0.61
BMP1 P13497 1/20 0.54
CNR2 P34972 1/20 0.53
ALDH1A1 P00352 2/20 0.51
GAA P10253 1/20 0.51
TP53 P04637 1/20 0.51
KCNH2 Q12809 1/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL6804511 0.86 ALDH1A1 (0.56) MMP1MMP2MMP9MMP8MMP13
SCHEMBL22469193 0.85 CNR2 (0.72) CNR2ALDH1A1GAATP53MEN1
SCHEMBL6803887 0.84 CNR2 (0.56) BMP1CNR2ALDH1A1GAATP53
SCHEMBL6797972 0.83 CNR2 (0.79) MMP1MMP2MMP9MMP8MMP13
SCHEMBL6803864 0.81 BMP1 (0.50) MMP1MMP2MMP9MMP8MMP13
SCHEMBL8607609 0.80 KEAP1 (0.64) CNR2ALDH1A1GAA
SCHEMBL6808058 0.80 ALDH1A1 (0.53) MMP1MMP2MMP9MMP8MMP13
SCHEMBL8200276 0.79 KEAP1 (0.62) CNR2ALDH1A1GAA
SCHEMBL6806990 0.79 PKM (0.52) MMP1MMP2MMP9MMP8MMP13
SCHEMBL7961836 0.77 KEAP1 (0.68) MMP1MMP2MMP9MMP8MMP13

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
WO-2004074238-A1 PHENETHYLAMINO SULFAMIC ACIDS THE PROCTER & GAMBLE COMPANY (US) 2004-09-02 WO disclosed
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 MMP1 857/4885MMP2 630/4885MMP9 2969/4885

“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.