SCHEMBL6725604

SCHEMBL6725604

CS(=O)(=O)c1ccc(-c2c(-c3ccc(C#N)cc3)noc2C(F)F)cc1F

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 7/20 0.37
EPAS1 Q99814 3/20 0.35
MAPK14 Q16539 4/20 0.35
CSNK1D P48730 3/20 0.35
MAPK9 P45984 1/20 0.35
MAPK10 P53779 1/20 0.35
F10 P00742 1/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32

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
SCHEMBL6720061 0.90 NR3C2 (0.36) PTGS2EPAS1
SCHEMBL6721402 0.89 PTGS2 (0.40) PTGS2CA12CA1CA2CA9
SCHEMBL6728553 0.88 PTGS2 (0.37) PTGS2MAPK14CSNK1DMAPK9MAPK10
SCHEMBL6721948 0.88 PTGS2 (0.48) PTGS2MAPK14CSNK1DMAPK9MAPK10
SCHEMBL6723710 0.87 PTGS2 (0.45) PTGS2MAPK14CSNK1DMAPK9MAPK10
SCHEMBL6729612 0.87 PTGS2 (0.39) PTGS2MAPK14CSNK1DMAPK9MAPK10
SCHEMBL6722731 0.87 PTGS2 (0.42) PTGS2MAPK14CSNK1DMAPK9MAPK10
SCHEMBL6726100 0.87 PTGS2 (0.35) PTGS2EPAS1CA1CA2
SCHEMBL6722738 0.87 PTGS2 (0.35) PTGS2EPAS1CA1CA2
SCHEMBL6719438 0.86 PTGS2 (0.52) PTGS2CA12CA1CA2CA9

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-20040092552-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2004-05-13 US disclosed
US-20020183362-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2002-12-05 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-20020183362-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation FPR2, FPR1, PTGES2 PTGS2 5/4885EPAS1 232/4885MAPK14 2499/4885
US-20040092552-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation FPR2, PTGES2, FPR1 PTGS2 5/4885EPAS1 281/4885MAPK14 2354/4885

“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.