SCHEMBL3382140

SCHEMBL3382140

O=S(=O)(O)Nc1ccc(Br)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.61
CA2 P00918 3/20 0.61
TGM2 P21980 1/20 0.55
PGR P06401 1/20 0.49
FKBP1A P62942 1/20 0.48
POLB P06746 1/20 0.46
IDO1 P14902 1/20 0.45
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
MMP1 P03956 1/20 0.45
MMP2 P08253 1/20 0.45
MMP9 P14780 1/20 0.45
MMP8 P22894 1/20 0.45
MMP13 P45452 1/20 0.45
PKM P14618 2/20 0.44
CA12 O43570 1/20 0.44
CA9 Q16790 1/20 0.44
ADORA3 P0DMS8 1/20 0.42
SLC6A3 Q01959 1/20 0.42
PTPRB P23467 2/20 0.42

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
SCHEMBL27183211 0.98 CA1 (0.59) CA1CA2TGM2PGRFKBP1A
SCHEMBL4455223 0.87 PTPRB (0.48) CA1CA2MEN1KMT2APKM
SCHEMBL4591628 0.78 CA1 (0.64) CA1CA2POLBMEN1KMT2A
SCHEMBL3041175 0.76 CA1 (0.52) CA1CA2IDO1MEN1KMT2A
SCHEMBL7863309 0.76 PTPRB (0.42) CA1CA2CA12CA9PTPRB
SCHEMBL7258179 0.76 CA1 (0.61) CA1CA2PGRFKBP1AMEN1
SCHEMBL27182660 0.76 PTPRB (0.42) CA1CA2CA12CA9PTPRB
SCHEMBL3365049 0.76 CA1 (0.61) CA1CA2TGM2PGRFKBP1A
SCHEMBL3088460 0.76 CA1 (0.61) CA1CA2PGRMEN1KMT2A
SCHEMBL1230858 0.76 KEAP1 (0.53) CA1CA2POLBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010017405-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF PAIN HELLER ADAM (US) 2010-02-11 WO claimed
US-20240332617-A1 COMPOSITION PRODUCTION METHOD AND NON-AQUEOUS ELECTROLYTE SOLUTION NIPPON SHOKUBAI CO., LTD. (JP) 2024-10-03 US disclosed
CN-113841280-B Electrolyte composition, solvent composition, nonaqueous electrolyte solution, and use thereof 株式会社日本触媒 2024-08-09 CN disclosed
CN-117480114-A Method for purifying aqueous sulfonimide solution, method for producing nonaqueous electrolyte solution, and method for producing electrolyte composition 株式会社日本触媒 2024-01-30 CN disclosed
CN-117480659-A Method for producing composition and nonaqueous electrolyte 株式会社日本触媒 2024-01-30 CN disclosed
WO-2023242845-A1 SULFAMATE BASED COVALENT LIGAND-DIRECTED RELEASE (CoLDR) COMPOUNDS YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2023-12-21 WO disclosed
US-20230406837-A1 SULFAMATE MODULATORS OF PIN1 ACTIVITY AND USES THEREOF YEDA RESEARCH AND DEVELOPMENT CO., LTD. (IL) 2023-12-21 US disclosed
CN-115088112-A Composition, electrolyte material, and electrolyte 株式会社日本触媒 2022-09-20 CN disclosed
WO-2010017405-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF PAIN HELLER ADAM (US) 2010-02-11 WO 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-20230406837-A1 SULFAMATE MODULATORS OF PIN1 ACTIVITY AND USES THEREOF PIN1, PSTPIP2, PIN4 CA1 765/4885CA2 1952/4885TGM2 2182/4885

“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.