SCHEMBL6608459

SCHEMBL6608459

CS(=O)(=O)NC(=O)c1ccc(-c2ccc(Br)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 2/20 0.62
ALDH1A1 P00352 1/20 0.54
OGG1 O15527 1/20 0.48
MAP4K4 O95819 1/20 0.48
P4HTM Q9NXG6 2/20 0.47
PTGS1 P23219 1/20 0.47
PTGS2 P35354 1/20 0.47
HDAC1 Q13547 4/20 0.46
HDAC6 Q9UBN7 2/20 0.46
SCN5A Q14524 1/20 0.45
HAO1 Q9UJM8 1/20 0.45
HDAC8 Q9BY41 1/20 0.44
HDAC3 O15379 1/20 0.44
HDAC2 Q92769 1/20 0.44
PTPN1 P18031 1/20 0.43

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
SCHEMBL7118965 0.94 ALDH1A1 (0.58) SCN9AALDH1A1OGG1P4HTMPTGS1
SCHEMBL31331542 0.84 SCN9A (0.64) SCN9AMAP4K4P4HTMPTPN1
SCHEMBL6607417 0.81 SCN9A (0.60) SCN9AMAP4K4P4HTMHDAC1HDAC6
SCHEMBL17940179 0.79 SCN9A (0.62) SCN9ASCN5APTPN1
SCHEMBL6611608 0.77 HDAC2 (0.63) OGG1HDAC1HDAC6HAO1HDAC8
SCHEMBL279954 0.77 HDAC1 (0.63) SCN9AALDH1A1P4HTMPTGS2HDAC1
SCHEMBL7990884 0.76 OGG1 (0.55) ALDH1A1OGG1PTGS1PTGS2HDAC1
SCHEMBL680289 0.76 MCL1 (0.70) SCN9AALDH1A1
SCHEMBL1647742 0.76 LMNA (0.54) SCN9AALDH1A1MAP4K4P4HTMPTPN1
SCHEMBL22097521 0.76 SCN9A (0.54) SCN9AMAP4K4P4HTMHDAC1HDAC6

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
US-20040266826-A1 Thiophenylthiopyrane dioxides as mmp or tnf-alpha inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-12-30 US disclosed
EP-1423386-A1 THIOPHENYLTHIOPYRANE DIOXIDES AS MMP OR TNF-ALPHA INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-06-02 EP disclosed
WO-2003022842-A1 THIOPHENYLTHIOPYRANE DIOXIDES AS MMP OR TNF-ALPHA INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-03-20 WO 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-20040266826-A1 Thiophenylthiopyrane dioxides as mmp or tnf-alpha inhibitors TNF, MMP9, MMP1 SCN9A 2646/4885ALDH1A1 440/4885OGG1 361/4885

“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.