SCHEMBL6722757

SCHEMBL6722757

Cc1ncccc1C1=C(c2ccc(CS(=O)(=O)Cc3ccc(C4=C(c5cccnc5C)CCC4)cc3F)c(F)c2)CCC1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 10/20 0.41
PTGER1 P34995 4/20 0.39
PTGS1 P23219 4/20 0.39
PDE3B Q13370 1/20 0.38
PDE3A Q14432 1/20 0.38
ALOX5AP P20292 2/20 0.37
FEN1 P39748 2/20 0.37
CHRM1 P11229 1/20 0.37
MKNK1 Q9BUB5 1/20 0.35
MKNK2 Q9HBH9 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35

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
SCHEMBL6722877 0.81 PTGS2 (0.51) PTGS2PTGS1
SCHEMBL6722092 0.81 PTGS2 (0.48) PTGS2PTGS1
SCHEMBL7046192 0.81 PTGS2 (0.49) PTGS2PTGS1PDE3BPDE3AALOX5AP
SCHEMBL6722728 0.81 PTGS2 (0.40) PTGS2PTGS1
SCHEMBL6725527 0.81 PTGS2 (0.45) PTGS2PTGER1PTGS1PDE3BPDE3A
SCHEMBL6721827 0.81 PDE3B (0.41) PTGS2PTGS1PDE3BPDE3AALOX5AP
SCHEMBL6721801 0.80 PTGS2 (0.47) PTGS2PTGS1
SCHEMBL6718983 0.80 PTGS2 (0.47) PTGS2PTGS1
SCHEMBL6718366 0.80 PTGS2 (0.50) PTGS2PTGS1
SCHEMBL6721860 0.80 PTGS2 (0.48) PTGS2PTGS1PDE3BPDE3AALOX5AP

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-20040092552-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2004-05-13 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-20040092552-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation FPR2, PTGES2, FPR1 PTGS2 5/4885PTGER1 18/4885PTGS1 4/4885

“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.