SCHEMBL6923978

SCHEMBL6923978

O=[N+]([O-])c1ccc(S(=O)(=O)NC(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.59
CA12 O43570 4/20 0.59
CA9 Q16790 4/20 0.59
MMP2 P08253 4/20 0.55
CA14 Q9ULX7 3/20 0.55
SLC1A3 P43003 1/20 0.54
SLC1A2 P43004 1/20 0.54
SLC1A1 P43005 1/20 0.54
CA1 P00915 3/20 0.53
MMP1 P03956 2/20 0.53
MMP9 P14780 2/20 0.53
MMP13 P45452 2/20 0.53
MMP8 P22894 1/20 0.53
CA3 P07451 1/20 0.53
CA4 P22748 1/20 0.53
CA6 P23280 1/20 0.53
CA5A P35218 1/20 0.53
CA7 P43166 1/20 0.53
CA13 Q8N1Q1 1/20 0.53
CA5B Q9Y2D0 1/20 0.53

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
SCHEMBL6929371 0.88 EEF2K (0.53) CA2CA12CA9MMP2CA14
SCHEMBL4950672 0.84 ALDH1A1 (0.62) CA2CA12CA9MMP2CA14
SCHEMBL4950680 0.84 ALDH1A1 (0.62) CA2CA12CA9MMP2CA14
SCHEMBL1491474 0.82 SLC1A3 (0.59) CA2CA12CA9MMP2CA14
SCHEMBL1491472 0.82 SLC1A3 (0.59) CA2CA12CA9MMP2CA14
SCHEMBL15332391 0.81 SLC1A3 (0.54) CA2CA12CA9MMP2CA14
SCHEMBL809970 0.81 SLC1A3 (0.54) CA2CA12CA9MMP2CA14
SCHEMBL31544497 0.81 SLC1A3 (0.54) CA2CA12CA9MMP2CA14
SCHEMBL13191160 0.81 SLC1A3 (0.54) CA2CA12CA9MMP2CA14
SCHEMBL6610112 0.79 SLC1A3 (0.55) CA2CA12CA9MMP2CA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1321454-A1 PROCESS FOR THE REMOVAL OF NITROBENZENESULFONYL Kaneka Corporation (JP) 2003-06-25 EP disclosed
US-6515179-B2 Reacting nitrobenzenesulfonyl group containing compound contacting with alkali metal alkoxide KANEKA CORPORATION (JP) 2003-02-04 US disclosed
US-20030009056-A1 PROCESS FOR THE REMOVAL OF NITROBENZENESULFONYL KANEKA CORPORATION (JP) 2003-01-09 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 (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-20030009056-A1 PROCESS FOR THE REMOVAL OF NITROBENZENESULFONYL NAAA, TST, AADAC CA2 644/4885CA12 2298/4885CA9 727/4885

“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.