SCHEMBL7541544

SCHEMBL7541544

Cc1ccc(C2=C(c3ccc(S(=O)(=O)NF)cc3)CCC2)cc1

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 15/20 0.66
PTGS1 P23219 6/20 0.51
SMN1; SMN2 Q16637 2/20 0.46
GAA P10253 1/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
THRB P10828 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
MMP1 P03956 1/20 0.44
MMP2 P08253 1/20 0.44
MMP9 P14780 1/20 0.44
MMP8 P22894 1/20 0.44
MMP13 P45452 1/20 0.44

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
SCHEMBL7542568 0.86 PTGS2 (0.49) PTGS2PTGS1MMP1MMP2MMP9
SCHEMBL7100203 0.82 GAA (0.64) SMN1; SMN2GAAALDH1A1LMNAL3MBTL1
SCHEMBL8652481 0.80 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL8652822 0.78 PTGS2 (0.72) PTGS2PTGS1CA1CA2
SCHEMBL7540369 0.78 PTGS2 (0.49) PTGS2PTGS1MMP1MMP2MMP9
SCHEMBL7538559 0.77 PTGS2 (0.46) PTGS2PTGS1MMP1MMP2MMP9
SCHEMBL7540175 0.77 PTGS2 (0.50) PTGS2PTGS1MMP1MMP2MMP9
SCHEMBL5071852 0.74 PTGS2 (0.69) PTGS2PTGS1SMN1; SMN2GAA
SCHEMBL7543918 0.74 PTGS2 (0.51) PTGS2PTGS1
SCHEMBL8266062 0.71 MAPK14 (0.62) PTGS2PTGS1LMNATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-20020183362-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation FPR2, FPR1, PTGES2 PTGS2 5/4885PTGS1 4/4885SMN1; SMN2 2004/4885

“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.