SCHEMBL1191609

SCHEMBL1191609

CC(CN(Cl)Cl)S(=O)(=O)O

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.31
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 1/20 0.30

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
SCHEMBL3381787 0.81
SCHEMBL5913713 0.77 ALDH1A1 (0.32) TP53
SCHEMBL28371972 0.75 ALDH1A1 (0.31) TP53
SCHEMBL21155856 0.72 CYP1A2 (0.48)
SCHEMBL1234589 0.71 SLC22A6 (0.33)
Water SCHEMBL30441965 0.71 SCN1A (0.34) TP53
SCHEMBL3381816 0.70
SCHEMBL11963160 0.70
SCHEMBL7617404 0.70 TP53 (0.32) TP53
SCHEMBL30173247 0.70 KDM4E (0.33)

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 51 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140227201-A1 Antimicrobial Gel Formulations NOVABAY PHARMACEUTICALS, INC. 2014-08-14 US claimed
EP-2531026-A1 POLYSACCHARIDE BASED ANTIMICROBIAL FORMULATIONS NovaBay Pharmaceuticals, Inc. (US) 2012-12-12 EP claimed
US-20120282351-A1 System and Method for The Prevention of Bacterial and Fungal Infections Including Urinary Tract Infections (UTI) Using N-Halogenated Amino Acids NOVABAY PHARMACEUTICALS, INC. 2012-11-08 US claimed
WO-2011097324-A1 POLYSACCHARIDE BASED ANTIMICROBIAL FORMULATIONS NOVABAY PHARMACEUTICALS, INC. (US) 2011-08-11 WO claimed
US-20110190392-A1 Polysaccharide Based Antimicrobial Formulations NOVABAY PHARMACEUTICALS, INC. 2011-08-04 US claimed
US-20110151025-A1 Compositions Comprising N-Halogenated or N,N-Dihalogenated Amine for Treatment and Prophylaxis of Bronchopulmonary Infections NOVABAY PHARMACEUTICALS, INC. 2011-06-23 US claimed
US-7893109-B2 N,N-dihalogenated amino acids and derivatives NOVABAY PHARMACEUTICALS, INC. (US) 2011-02-22 US claimed
EP-2265267-A1 COMPOSITIONS COMPRISING N-HALOGENATED OR N, N-DIHALOGENATED AMINE FOR TREATMENT AND PROPHYLAXIS OF BRONCHOPULMONARY INFECTIONS NovaBay Pharmaceuticals, Inc. (US) 2010-12-29 EP claimed
US-20100272783-A1 Methods of Treating Infections of the Nail NOVABAY PHARMACEUTICALS, INC. 2010-10-28 US claimed
US-20100076089-A1 ANTIMICROBIAL GEL FORMULATIONS NOVABAY PHARMACEUTICALS, INC. 2010-03-25 US claimed
EP-1948154-A1 SYSTEM AND METHOD FOR THE PREVENTION OF BACTERIAL AND FUNGAL INFECTIONS INCLUDING URINARY TRACT INFECTIONS (UTI) USING N-HALOGENATED AMINO ACIDS Novabay Pharmaceuticals, Inc. (US) 2008-07-30 EP claimed
EP-1896001-A1 N-HALOGENATED AMINO ACIDS AND N, N-DIHALOGENATED AMINO ACIDS IN COMBINATION WITH HYPOHALOUS ACIDS Novabay Pharmaceuticals, Inc. (US) 2008-03-12 EP claimed
EP-1656095-A4 N,N-DIHALOGENATED AMINO ACIDS AND DERIVATIVES NOVACAL PHARMACEUTICALS INC (US) 2007-11-28 EP claimed
US-20070244449-A1 System and method for the prevention of bacterial and fungal infections including Urinary Tract Infections (UTI) using N-halogenated amino acids NOVACAL PHARMACEUTICALS, INC. 2007-10-18 US claimed
WO-2007044559-A1 SYSTEM AND METHOD FOR THE PREVENTION OF BACTERIAL AND FUNGAL INFECTIONS INCLUDING URINARY TRACT INFECTIONS (UTI) USING N-HALOGENATED AMINO ACIDS NOVABAY PHARMACEUTICALS, INC. (US) 2007-04-19 WO claimed
US-20060247209-A1 N-halogenated amino acids, N,N-dihalogenated amino acids and derivatives; compositions and methods of using them NOVABAY PHARMACEUTICALS, INC. 2006-11-02 US claimed
WO-2006081392-A1 N-HALOGENATED AMINO ACIDS AND N, N-DIHALOGENATED AMINO ACIDS IN COMBINATION WITH HYPOHALOUS ACIDS NOVABAY PHARMACEUTICALS, INC. (US) 2006-08-03 WO claimed
EP-1656095-A2 N,N-DIHALOGENATED AMINO ACIDS AND DERIVATIVES NovaCal Pharmaceuticals, Inc. (US) 2006-05-17 EP claimed
US-20050065115-A1 N,N-dihalogenated amino acids and derivatives NOVABAY PHARMACEUTICALS, INC. 2005-03-24 US claimed
WO-2005020896-A2 N,N-DIHALOGENATED AMINO ACIDS AND DERIVATIVES NOVACAL PHARMACEUTICALS, INC. (US) 2005-03-10 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 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-20100272783-A1 Methods of Treating Infections of the Nail POLR1C, TYR, NACA TP53 1117/4885CA12 3048/4885CA1 4102/4885
US-20140227201-A1 Antimicrobial Gel Formulations CUTA, TUBA3C, POLR1C TP53 1647/4885CA12 4659/4885CA1 4807/4885
US-20110151025-A1 Compositions Comprising N-Halogenated or N,N-Dihalogenated Amine for Treatment and Prophylaxis of Bronchopulmonary Infections CFTR, NAT1, ELANE TP53 3000/4885CA12 3693/4885CA1 4304/4885
US-20050065115-A1 N,N-dihalogenated amino acids and derivatives DAO, DDC, NRDC TP53 1177/4885CA12 4770/4885CA1 4651/4885
US-20100076089-A1 ANTIMICROBIAL GEL FORMULATIONS CUTA, TUBA3C, POLR1C TP53 1647/4885CA12 4659/4885CA1 4807/4885
US-20060247209-A1 N-halogenated amino acids, N,N-dihalogenated amino acids and derivatives; compositions and methods of using them DAO, ASNS, DDC TP53 998/4885CA12 4591/4885CA1 3944/4885
US-20110190392-A1 Polysaccharide Based Antimicrobial Formulations FUT6, FUT5, OGT TP53 3338/4885CA12 2688/4885CA1 3907/4885

“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.