SCHEMBL7540175

SCHEMBL7540175

O=S(=O)(NF)c1ccc(C2=C(c3cccc(Cl)c3)CCC2)cc1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 16/20 0.50
PTGS1 P23219 9/20 0.50
SLC6A3 Q01959 3/20 0.47
SLC6A2 P23975 1/20 0.43
MMP1 P03956 1/20 0.42
MMP2 P08253 1/20 0.42
MMP3 P08254 1/20 0.42
MMP7 P09237 1/20 0.42
MMP9 P14780 1/20 0.42
MMP8 P22894 1/20 0.42
MMP13 P45452 1/20 0.42
MMP14 P50281 1/20 0.42

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
SCHEMBL7540369 0.85 PTGS2 (0.49) PTGS2PTGS1MMP1MMP2MMP3
SCHEMBL7542568 0.84 PTGS2 (0.49) PTGS2PTGS1MMP1MMP2MMP3
SCHEMBL7538559 0.84 PTGS2 (0.46) PTGS2PTGS1MMP1MMP2MMP3
SCHEMBL7543918 0.81 PTGS2 (0.51) PTGS2PTGS1
SCHEMBL7541544 0.77 PTGS2 (0.66) PTGS2PTGS1MMP1MMP2MMP9
SCHEMBL8388671 0.76 SLC6A3 (0.54) PTGS2SLC6A3SLC6A2
SCHEMBL6719083 0.72 PTGS2 (0.56) PTGS2PTGS1SLC6A3SLC6A2
SCHEMBL7042617 0.72 PTGS2 (0.56) PTGS2PTGS1SLC6A3SLC6A2
SCHEMBL6722804 0.71 PTGS2 (0.45) PTGS2PTGS1SLC6A3SLC6A2
SCHEMBL6728669 0.70 PTGS2 (0.53) PTGS2PTGS1SLC6A3SLC6A2

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 4/4885SLC6A3 4728/4885

“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.