SCHEMBL6729964

SCHEMBL6729964

Cc1cc(-c2[nH]c(C(F)F)nc2-c2ccc(S(C)(=O)=O)c(F)c2)ccc1OC(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 4/20 0.37
PDE2A O00408 2/20 0.35
PIK3CD O00329 1/20 0.33
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
PIK3CG P48736 1/20 0.33
TYK2 P29597 6/20 0.33
SCN5A Q14524 1/20 0.33
PTGS2 P35354 2/20 0.33
CYP3A4 P08684 2/20 0.32
MAPK14 Q16539 2/20 0.32
XDH P47989 1/20 0.32
PTGS1 P23219 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
SCHEMBL6723614 0.93 GRM2 (0.34) GRM2PDE2APIK3CDPIK3CAPIK3CB
SCHEMBL6739026 0.90 PDE2A (0.35) GRM2PDE2ASCN5APTGS2PTGS1
SCHEMBL6735775 0.89 PTGS2 (0.36) GRM2PDE2ATYK2SCN5APTGS2
SCHEMBL6723012 0.87 GRM2 (0.38) GRM2PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL6723512 0.86 PTGS2 (0.36) PIK3CDPIK3CAPIK3CBPIK3CGSCN5A
SCHEMBL6729929 0.86 PTGS2 (0.38) PIK3CDPIK3CAPIK3CBPIK3CGTYK2
SCHEMBL6721430 0.86 TGFBR1 (0.41) PIK3CDPIK3CAPIK3CBPIK3CGTYK2
SCHEMBL6723540 0.85 KIF11 (0.38) GRM2PDE2APIK3CDPIK3CAPIK3CB
SCHEMBL6722868 0.85 MAPK14 (0.42) CYP3A4MAPK14XDHPTGS1
SCHEMBL6729827 0.85 PIK3CD (0.38) PIK3CDPIK3CAPIK3CBPIK3CGTYK2

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 4 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
EP-1296971-A2 2-FLUOROBENZENESULFONYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION Pharmacia Corporation (US) 2003-04-02 EP disclosed
US-20020183362-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2002-12-05 US disclosed
WO-2001081332-A2 2-FLUOROBENZENESULFONYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION PHARMACIA CORPORATION (US) 2001-11-01 WO 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 GRM2 893/4885PDE2A 2301/4885PIK3CD 4290/4885
US-20040092552-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation FPR2, PTGES2, FPR1 GRM2 814/4885PDE2A 2234/4885PIK3CD 4382/4885

“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.