SCHEMBL6720849

SCHEMBL6720849

Cc1ccc(-c2cccnc2-c2ccc(CS(=O)(=O)Cc3ccc(-c4ncccc4-c4ccc(C)c(OC(F)(F)F)c4)cc3F)c(F)c2)cc1OC(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 6/20 0.35
ALOX5AP P20292 5/20 0.35
KMO O15229 1/20 0.35
PTGS2 P35354 2/20 0.34
PTGS1 P23219 1/20 0.34
TGFBR1 P36897 1/20 0.34
SCN9A Q15858 4/20 0.34
GRM2 Q14416 1/20 0.34
CYP2C9 P11712 1/20 0.34
SCN5A Q14524 1/20 0.34
TRPV1 Q8NER1 1/20 0.33
BDKRB1 P46663 1/20 0.33
NAAA Q02083 1/20 0.33
CYP3A4 P08684 1/20 0.33
FFAR1 O14842 1/20 0.32
FFAR4 Q5NUL3 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
SCHEMBL6723304 0.92 FFAR1 (0.38) FEN1ALOX5APKMOPTGS2PTGS1
SCHEMBL6723509 0.86 FEN1 (0.40) FEN1ALOX5APKMOPTGS2PTGS1
SCHEMBL6719287 0.85 FEN1 (0.38) FEN1ALOX5APKMOPTGS2PTGS1
SCHEMBL6723873 0.85 CHRM5 (0.40) PTGS2PTGS1SCN9ASCN5ATRPV1
SCHEMBL7046231 0.84 SYK (0.40) FEN1ALOX5APKMOPTGS2PTGS1
SCHEMBL6723256 0.84 KCNA5 (0.46) FEN1
SCHEMBL6723669 0.83 KMO (0.41) FEN1ALOX5APKMOPTGS2PTGS1
SCHEMBL6723491 0.83 PTGS1 (0.39) FEN1ALOX5APKMOPTGS2PTGS1
SCHEMBL6722770 0.83 KMO (0.38) FEN1ALOX5APKMOPTGS2PTGS1
SCHEMBL6721590 0.83 KMO (0.43) FEN1ALOX5APKMOPTGS2PTGS1

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 FEN1 1713/4885ALOX5AP 395/4885KMO 675/4885

“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.