SCHEMBL29437620

SCHEMBL29437620

O=S1(=O)N=CNc2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 5/20 1.00
CA12 O43570 4/20 1.00
CA2 P00918 4/20 1.00
CA9 Q16790 4/20 1.00
KMT2A Q03164 4/20 0.43
MEN1 O00255 2/20 0.43
NOX1 Q9Y5S8 1/20 0.43
LMNA P02545 2/20 0.41
CYP3A4 P08684 1/20 0.41
TSHR P16473 1/20 0.41
NFKB1 P19838 1/20 0.41
BLM P54132 1/20 0.41
CA4 P22748 2/20 0.38
CA7 P43166 2/20 0.38
PLCG1 P19174 1/20 0.36
SHMT2 P34897 1/20 0.36
PLAU P00749 1/20 0.35
AKR1B1 P15121 1/20 0.35
ALDH1A1 P00352 1/20 0.34
CYP2D6 P10635 1/20 0.33

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
SCHEMBL718969 1.00 CA1 (1.00) CA1CA12CA2CA9KMT2A
Hydrochloric Acid SCHEMBL28023173 0.98 CA1 (0.96) CA1CA12CA2CA9KMT2A
SCHEMBL6496816 0.73 CA1 (0.58) CA1CA12CA2CA9LMNA
SCHEMBL2776254 0.73 CA1 (0.58) CA1CA12CA2CA9LMNA
SCHEMBL28961017 0.73 CA1 (0.58) CA1CA12CA2CA9KMT2A
SCHEMBL2777400 0.73 CA1 (0.58) CA1CA12CA2CA9LMNA
SCHEMBL6494977 0.73 CA1 (0.58) CA1CA12CA2CA9KMT2A
SCHEMBL6505477 0.73 CA1 (0.58) CA1CA12CA2CA9LMNA
SCHEMBL30070404 0.73 CA1 (0.58) CA1CA12CA2CA9KMT2A
SCHEMBL10082924 0.73 CA1 (0.58) CA1CA12CA2CA9LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113773277-B Synthesis method of 4H-1,2, 4-benzothiadiazine-1, 1-dioxide derivative 兰州大学 2023-12-05 CN claimed
CN-117285484-B Benzothiadiazine 1, 1-dioxide compounds inhibiting HDAC6 enzyme, preparation method and application thereof Shanghai Pharmaceutical Industry Research Institute Co.,Ltd. (CN) 2026-05-26 CN disclosed
WO-2025076455-A1 MRGPRX2 MODULATORS AND RELATED METHODS OF TREATMENT Escient Pharmaceuticals Inc. (US) 2025-04-10 WO disclosed
CN-119504808-A Compound, preparation method and application thereof 四川科伦药物研究院有限公司 2025-02-25 CN disclosed
US-20240199613-A1 POLYCYCLIC INHIBITORS OF PLASMA KALLIKREIN TAKEDA PHARMACEUTICALS CO (JP) 2024-06-20 US disclosed
CN-117946012-A Preparation method of nitrogen-containing heterocycle 温州理工学院 2024-04-30 CN disclosed
CN-117285484-A Benzothiadiazine 1, 1-dioxide compounds inhibiting HDAC6 enzyme, preparation method and application thereof 上海医药工业研究院有限公司 2023-12-26 CN disclosed
CN-113773277-B Synthesis method of 4H-1,2, 4-benzothiadiazine-1, 1-dioxide derivative 兰州大学 2023-12-05 CN disclosed
CN-113773277-B Synthesis method of 4H-1,2, 4-benzothiadiazine-1, 1-dioxide derivative 兰州大学 2023-12-05 CN disclosed
CN-113773277-B Synthesis method of 4H-1,2, 4-benzothiadiazine-1, 1-dioxide derivative 兰州大学 2023-12-05 CN disclosed
CN-111410638-B Benzothiadiazine methoxyl acrylate derivatives, and preparation method and application thereof 天津农学院 2022-03-29 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-20240199613-A1 POLYCYCLIC INHIBITORS OF PLASMA KALLIKREIN KLKB1, KLK1, KLK5 CA1 1382/4885CA12 1492/4885CA2 2623/4885

“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.