SCHEMBL6808058

SCHEMBL6808058

Cc1ccc(S(=O)(=O)N(CCc2ccc(NS(=O)(=O)O)cc2)CC(=O)O)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.53
TP53 P04637 2/20 0.53
CNR2 P34972 2/20 0.52
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
CA12 O43570 2/20 0.50
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
CA4 P22748 2/20 0.50
CA9 Q16790 2/20 0.50
GAA P10253 1/20 0.50
THRB P10828 1/20 0.49
BMP1 P13497 2/20 0.48
MMP1 P03956 1/20 0.48
MMP2 P08253 1/20 0.48
MMP9 P14780 1/20 0.48
MMP8 P22894 1/20 0.48
MMP13 P45452 1/20 0.48
KEAP1 Q14145 1/20 0.46
NFE2L2 Q16236 1/20 0.46

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
SCHEMBL6798304 0.87 THRB (0.51) ALDH1A1TP53CNR2MEN1KMT2A
SCHEMBL6802688 0.85 CNR2 (0.75) TP53CNR2MEN1KMT2ACA12
SCHEMBL22469193 0.84 CNR2 (0.72) ALDH1A1TP53CNR2MEN1KMT2A
SCHEMBL6803887 0.83 CNR2 (0.56) ALDH1A1TP53CNR2MEN1KMT2A
SCHEMBL6803763 0.83 CNR2 (0.48) ALDH1A1TP53CNR2MEN1KMT2A
SCHEMBL6801277 0.82 CNR2 (0.47) ALDH1A1TP53CNR2MEN1KMT2A
SCHEMBL6801648 0.80 MMP1 (0.61) ALDH1A1TP53CNR2MEN1KMT2A
SCHEMBL8607609 0.79 KEAP1 (0.64) ALDH1A1CNR2CA12CA2CA9
SCHEMBL6800802 0.79 ALDH1A1 (0.47) ALDH1A1TP53CNR2MEN1KMT2A
SCHEMBL6803488 0.79 LIMK2 (0.49) ALDH1A1TP53CNR2MEN1KMT2A

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
WO-2004074238-A1 PHENETHYLAMINO SULFAMIC ACIDS THE PROCTER & GAMBLE COMPANY (US) 2004-09-02 WO claimed
US-20040167183-A1 Phenethylamino sulfamic acids THE PROCTER & GAMBLE COMPANY 2004-08-26 US claimed
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 ALDH1A1 622/4885TP53 1609/4885CNR2 4684/4885

“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.