SCHEMBL6804564

SCHEMBL6804564

CNC(=O)CC(NS(=O)(=O)c1ccccc1)c1ccc(NS(=O)(=O)O)cc1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.49
ATM Q13315 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
ITGB3 P05106 1/20 0.47
ITGAV P06756 1/20 0.47
EEF2K O00418 4/20 0.46
PKM P14618 1/20 0.44
RECQL P46063 1/20 0.44
MMP2 P08253 1/20 0.43
MMP9 P14780 1/20 0.43
HDAC8 Q9BY41 3/20 0.42
KMT2A Q03164 2/20 0.42
HDAC1 Q13547 3/20 0.41
HDAC4 P56524 1/20 0.40
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.40
SCN3A Q9NY46 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
SCHEMBL6803129 0.80 PTPRB (0.52) ALDH1A1
SCHEMBL6799601 0.77 POLB (0.60) ALDH1A1L3MBTL1PKMMMP2KMT2A
SCHEMBL6804556 0.75 HDAC1 (0.55) ALDH1A1MMP2MMP9HDAC1POLB
SCHEMBL6804558 0.75 HDAC1 (0.55) ALDH1A1MMP2MMP9HDAC1POLB
SCHEMBL12861485 0.74 MMP2 (0.45) ALDH1A1ATML3MBTL1ITGB3ITGAV
SCHEMBL28404274 0.73 ATM (0.76) ALDH1A1ATML3MBTL1ITGB3ITGAV
SCHEMBL28398275 0.70 EEF2K (0.80) ALDH1A1ATML3MBTL1ITGB3ITGAV
SCHEMBL5700825 0.69 ALDH1A1 (0.52) ALDH1A1ATML3MBTL1ITGB3ITGAV
SCHEMBL5700833 0.69 ALDH1A1 (0.52) ALDH1A1ATML3MBTL1ITGB3ITGAV
SCHEMBL7418486 0.69 ATM (0.57) ALDH1A1ATML3MBTL1EEF2KMMP2

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 4 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
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 ALDH1A1 622/4885ATM 2855/4885L3MBTL1 3997/4885

“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.