SCHEMBL19891667

SCHEMBL19891667

CC(CCOc1ccc(S(=O)(=O)N=[N+]=[N-])cc1)CCC(C)CCOc1ccc(S(=O)(=O)N=[N+]=[N-])cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 4/20 0.38
▸ CA2 P00918 4/20 0.38
▸ CA9 Q16790 4/20 0.38
▸ CA12 O43570 3/20 0.38
▸ CA7 P43166 3/20 0.38
▸ TSHR P16473 2/20 0.38
▸ MMP2 P08253 2/20 0.38
▸ MMP9 P14780 2/20 0.38
▸ MMP13 P45452 2/20 0.38
▸ MMP8 P22894 1/20 0.38
▸ CA4 P22748 1/20 0.38
▸ CA5A P35218 1/20 0.38
▸ CA5B Q9Y2D0 1/20 0.38
▸ MMP3 P08254 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.36
▸ MAPK1 P28482 2/20 0.36
▸ FDPS P14324 2/20 0.35
▸ EPHX2 P34913 1/20 0.35
▸ ALOX5 P09917 1/20 0.33
▸ GGPS1 O95749 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
SCHEMBL19874475 0.82 CA12 (0.44) CA1CA2CA9CA12CA7
SCHEMBL19874527 0.82 CA12 (0.44) CA1CA2CA9CA12CA7
SCHEMBL19887232 0.81 CA1 (0.39) CA1CA2CA9CA12CA7
SCHEMBL14805176 0.79 CA12 (0.54) CA1CA2CA9CA12CA7
SCHEMBL19891714 0.78 CA1 (0.35) CA1CA2CA9CA12CA7
SCHEMBL14798088 0.77 CA1 (0.35) CA1CA2CA9CA12CA7
SCHEMBL26812 0.77 HTT (0.47) CA1CA2CA9TSHRCA5A
SCHEMBL14805173 0.76 CA1 (0.35) CA1CA2CA9CA12CA7
SCHEMBL14798582 0.76 TSHR (0.39) CA1CA2CA9CA12CA7
SCHEMBL14798634 0.76 CA12 (0.39) CA1CA2CA9CA12CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 CA1 2823/4885CA2 1475/4885CA9 2023/4885
US-20180050988-A1 NON EXPLOSIVE BIS-SULFONYL AZIDES ARSA, MSRB3, NES CA1 2828/4885CA2 1444/4885CA9 1954/4885

“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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