SCHEMBL19874475

SCHEMBL19874475

[N-]=[N+]=NS(=O)(=O)c1ccc(OCCCCCCCCCCOc2ccc(S(=O)(=O)N=[N+]=[N-])cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 8/20 0.44
▸ CA1 P00915 8/20 0.44
▸ CA2 P00918 8/20 0.44
▸ CA9 Q16790 8/20 0.44
▸ CA4 P22748 4/20 0.44
▸ CA7 P43166 2/20 0.44
▸ TSHR P16473 2/20 0.44
▸ HRH3 Q9Y5N1 3/20 0.39
▸ GAA P10253 1/20 0.39
▸ KCNH2 Q12809 1/20 0.38
▸ MGLL Q99685 1/20 0.38
▸ MAPK1 P28482 1/20 0.37
▸ RECQL P46063 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37

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
SCHEMBL19874527 1.00 CA12 (0.44) CA12CA1CA2CA9CA4
SCHEMBL19887232 0.89 CA1 (0.39) CA12CA1CA2CA9CA4
SCHEMBL22064308 0.85 CA1 (0.35) CA12CA1CA2CA9CA4
SCHEMBL14798639 0.85 CA12 (0.38) CA12CA1CA2CA9CA4
SCHEMBL14798633 0.85 CA12 (0.38) CA12CA1CA2CA9CA4
SCHEMBL14805173 0.83 CA1 (0.35) CA12CA1CA2CA9CA4
SCHEMBL14805176 0.83 CA12 (0.54) CA12CA1CA2CA9CA7
SCHEMBL14798582 0.83 TSHR (0.39) CA12CA1CA2CA9CA7
SCHEMBL14797996 0.83 CA12 (0.36) CA12CA1CA2CA9CA4
SCHEMBL14798078 0.83 CA1 (0.39) CA12CA1CA2CA9CA4

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
CN-107406379-B Non-explosive bis-sulfonyl azides 戴纳米特诺贝尔爆炸材料和系统工程有限公司 2020-10-16 — — CN claimed
EP-3268352-B1 NON EXPLOSIVE BIS-SULFONYL AZIDES DYNAMIT NOBEL GMBH EXPLOSIVSTOFF UND SYSTEMTECHNIK (DE) 2020-06-10 — — EP claimed
US-10385016-B2 Non explosive bis-sulfonyl azides DYNAMIT NOBEL GMBH EXPLOSIVSTOFF-UND SYSTEMTECHNIK (DE) 2019-08-20 — — US claimed
US-20180050988-A1 NON EXPLOSIVE BIS-SULFONYL AZIDES DYNAMIT NOBEL GMBH EXPLOSIVSTOFF- UND SYSTEMTECHNIK (DE) 2018-02-22 — — US claimed
CN-107406379-B Non-explosive bis-sulfonyl azides 戴纳米特诺贝尔爆炸材料和系统工程有限公司 2020-10-16 — — CN disclosed
EP-3268352-B1 NON EXPLOSIVE BIS-SULFONYL AZIDES DYNAMIT NOBEL GMBH EXPLOSIVSTOFF UND SYSTEMTECHNIK (DE) 2020-06-10 — — EP disclosed
US-10385016-B2 Non explosive bis-sulfonyl azides DYNAMIT NOBEL GMBH EXPLOSIVSTOFF-UND SYSTEMTECHNIK (DE) 2019-08-20 — — US disclosed
US-20180050988-A1 NON EXPLOSIVE BIS-SULFONYL AZIDES DYNAMIT NOBEL GMBH EXPLOSIVSTOFF- UND SYSTEMTECHNIK (DE) 2018-02-22 — — US disclosed
US-20180050988-A1 NON EXPLOSIVE BIS-SULFONYL AZIDES DYNAMIT NOBEL GMBH EXPLOSIVSTOFF- UND SYSTEMTECHNIK (DE) 2018-02-22 — — 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 (2 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-10385016-B2 Non explosive bis-sulfonyl azides ARSA, MSRB3, NES CA12 3555/4885CA1 2823/4885CA2 1475/4885
US-20180050988-A1 NON EXPLOSIVE BIS-SULFONYL AZIDES ARSA, MSRB3, NES CA12 3519/4885CA1 2828/4885CA2 1444/4885

“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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