SCHEMBL30628487

SCHEMBL30628487

NS(=O)(=O)c1ccc(CCNC(=O)c2ccc(Cl)cc2)cc1

nearest known ligand 0.86

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 7/20 0.86
▸ CA2 P00918 7/20 0.86
▸ CA9 Q16790 5/20 0.86
▸ CA12 O43570 4/20 0.86
▸ MEN1 O00255 3/20 0.72
▸ KMT2A Q03164 3/20 0.72
▸ RXFP1 Q9HBX9 1/20 0.72
▸ CA7 P43166 1/20 0.70
▸ CA14 Q9ULX7 1/20 0.70
▸ KDM4E B2RXH2 1/20 0.68
▸ L3MBTL1 Q9Y468 1/20 0.68
▸ SMN1; SMN2 Q16637 2/20 0.68
▸ NPC1 O15118 1/20 0.68
▸ CYP1A2 P05177 1/20 0.68
▸ GAA P10253 1/20 0.68
▸ CYP2D6 P10635 1/20 0.68
▸ MAPT P10636 1/20 0.68
▸ CYP2C19 P33261 1/20 0.68
▸ RAB9A P51151 1/20 0.68
▸ GFER P55789 1/20 0.68

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
SCHEMBL4305965 0.87 CA1 (0.89) CA1CA2CA9CA12MEN1
SCHEMBL13401865 0.86 CA1 (0.86) CA1CA2CA9CA12MEN1
SCHEMBL15888499 0.86 CA1 (0.86) CA1CA2CA9CA12MEN1
SCHEMBL6046379 0.86 MEN1 (0.90) CA1CA2CA9CA12MEN1
SCHEMBL8868584 0.86 CA2 (0.86) CA1CA2CA9CA12MEN1
SCHEMBL11807861 0.84 MEN1 (0.87) CA1CA2CA9CA12MEN1
SCHEMBL11887649 0.84 CA1 (0.77) CA1CA2CA9CA12MEN1
SCHEMBL11626316 0.84 CA1 (0.62) CA1CA2CA9CA12MEN1
SCHEMBL28582955 0.84 MEN1 (1.00) CA1CA2CA9CA12MEN1
SCHEMBL11887789 0.84 CA1 (0.82) CA1CA2CA9CA12MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117003764-A Cycloheptenone compound, its preparation method and its application in preventing and treating inflammatory diseases 中国医学科学院药物研究所 2023-11-07 — — CN claimed
EP-3796945-B1 ONE-STEP, FAST, 18F-19F ISOTOPIC EXCHANGE RADIOLABELING OF DIFLUORO-DIOXABORININS AND USE OF SUCH COMPOUNDS IN TREATMENT UNIV CORNELL (US) 2025-08-06 — — EP disclosed
US-12378261-B2 One-step, fast, 18F-19F isotopic exchange radiolabeling of difluoro-dioxaborinins and use of such compounds in treatment CORNELL UNIVERSITY (US) 2025-08-05 — — US disclosed
CN-119463200-A Preparation method, product and application of dandelion-shaped single-chain particles 复旦大学 2025-02-18 — — CN disclosed
CN-118852065-A Multifunctional alicyclic epoxy monomer and preparation method and application thereof 中山大学 2024-10-29 — — CN disclosed
CN-118130757-A Onsite identification method of land natural gas hydrate 中国地质调查局油气资源调查中心 2024-06-04 — — CN disclosed
CN-117003764-A Cycloheptenone compound, its preparation method and its application in preventing and treating inflammatory diseases 中国医学科学院药物研究所 2023-11-07 — — CN 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-12378261-B2 One-step, fast, 18F-19F isotopic exchange radiolabeling of difluoro-dioxaborinins and use of such compounds in treatment AFF1, FGFR1, AFF2 CA1 2801/4885CA2 2252/4885CA9 627/4885

“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.

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