SCHEMBL6354562

SCHEMBL6354562

NC(=O)c1nn(-c2ccc(S(N)(=O)=O)cc2)c2c1ccc1ccc(NC(=O)c3ccccc3C(F)(F)F)cc12

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 7/20 0.46
PTGS1 P23219 3/20 0.46
EPHX2 P34913 3/20 0.46
CA1 P00915 4/20 0.43
CA2 P00918 4/20 0.43
CA9 Q16790 4/20 0.43
CA12 O43570 2/20 0.43
CA5A P35218 1/20 0.43
CA5B Q9Y2D0 1/20 0.43
PDPK1 O15530 3/20 0.43
PTPRC P08575 1/20 0.42
PTGES O14684 2/20 0.42
CA4 P22748 1/20 0.40

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
SCHEMBL6340636 0.93 PTGES (0.43) PTGS2PTGS1EPHX2PDPK1PTPRC
SCHEMBL6343697 0.89 PTGS2 (0.46) PTGS2PTGS1EPHX2CA1CA2
SCHEMBL6626661 0.88 PTGS2 (0.46) PTGS2PTGS1EPHX2CA1CA2
SCHEMBL6342809 0.87 PTGS2 (0.49) PTGS2CA1CA2CA9CA12
SCHEMBL6340626 0.87 KMT2A (0.55) PTGS2PTGS1EPHX2CA1CA2
SCHEMBL6342129 0.85 PTGS2 (0.55) PTGS2CA1CA2CA9CA12
SCHEMBL6342790 0.85 PTGS2 (0.50) PTGS2PTGS1EPHX2CA1CA2
SCHEMBL6350930 0.84 KMT2A (0.46) PTGS2PTGS1CA1CA2CA9
SCHEMBL6342695 0.83 IKBKB (0.51) PTGS2PTGS1
SCHEMBL6344535 0.83 KMT2A (0.54) PTGS2PTGS1EPHX2CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1438293-A2 SUBSTITUTED PYRAZOLYL BENZENESULFAMIDE COMPOUNDS FOR THE TREATMENT OF INFLAMMATION Pharmacia Corporation (US) 2004-07-21 EP claimed
US-20030125361-A1 Substituted pyrazolyl benzenesulfamide compounds for the treatment of inflammation PHARMACIA CORPORATION 2003-07-03 US claimed
WO-2003027075-A2 SUBSTITUTED PYRAZOLYL BENZENESULFAMIDE COMPOUNDS FOR THE TREATMENT OF INFLAMMATION PHARMACIA CORPORATION (US) 2003-04-03 WO claimed
US-6849653-B2 1H-benzo(g)indazole compounds as anticarcinogenic agents and also treat arthritis PHARMACIA CORPORATION (US) 2005-02-01 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-20030125361-A1 Substituted pyrazolyl benzenesulfamide compounds for the treatment of inflammation IRAK4, NLRP3, CXCL8 PTGS2 37/4885PTGS1 29/4885EPHX2 2152/4885

“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.