SCHEMBL8639255

SCHEMBL8639255

NS(=O)(=O)c1ccccc1-n1ncc(Cl)c1-c1ccc(Cl)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 10/20 0.54
PTGS1 P23219 8/20 0.54
LMNA P02545 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
CA2 P00918 3/20 0.43
CA12 O43570 2/20 0.43
CA1 P00915 2/20 0.43
CA9 Q16790 2/20 0.43
CA7 P43166 1/20 0.42
KDM4E B2RXH2 1/20 0.41
GAA P10253 1/20 0.41
HTT P42858 1/20 0.41
AURKA O14965 1/20 0.39
CNR1 P21554 2/20 0.38
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
CNR2 P34972 1/20 0.37
PPARG P37231 1/20 0.37

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
SCHEMBL7059925 0.92 PTGS2 (0.64) PTGS2PTGS1LMNANPSR1CA2
SCHEMBL8689254 0.90 PTGS2 (0.52) PTGS2PTGS1LMNANPSR1CA2
SCHEMBL8693265 0.90 PTGS2 (0.52) PTGS2PTGS1LMNANPSR1CA2
SCHEMBL8689121 0.88 PTGS2 (0.62) PTGS2PTGS1LMNANPSR1CA2
SCHEMBL8638997 0.87 PTGS2 (0.52) PTGS2PTGS1LMNANPSR1CA2
SCHEMBL8692201 0.87 HTT (0.49) PTGS2PTGS1LMNANPSR1CA2
SCHEMBL8691630 0.86 PTGS2 (0.65) PTGS2PTGS1LMNANPSR1CA2
SCHEMBL7773923 0.83 PTGS2 (0.52) PTGS2PTGS1CA2CA1CA9
SCHEMBL8693825 0.82 PTGS2 (0.46) PTGS2PTGS1CA2CA12CA1
SCHEMBL8691904 0.81 PTGS2 (0.49) PTGS2PTGS1CA2CA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5760068-A NONSTEROIDAL ANTIINFLAMMATORY AGENTS WITH REDUCED SIDE EFFECTS G.D. SEARLE & CO. (US) 1998-06-02 US claimed
US-5760068-A NONSTEROIDAL ANTIINFLAMMATORY AGENTS WITH REDUCED SIDE EFFECTS G.D. SEARLE & CO. (US) 1998-06-02 US disclosed
US-5756529-A ANTIINFLAMMATORY G.D. SEARLE & CO. (US) 1998-05-26 US disclosed
US-5753688-A ANTIINFLAMMATORY TALLEY JOHN J (US) 1998-05-19 US disclosed
EP-0731795-A1 SUBSTITUTED PYRAZOLYL BENZENESULFONAMIDES FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1996-09-18 EP disclosed
US-5510496-A ANTIINFLAMMATORY AGENTS G.D. SEARLE & CO. (US) 1996-04-23 US disclosed
US-5504215-A Substituted pyrazolyl benzenesulfonamide compounds for the treatment of inflammation G. D. SEARLE & CO. (US) 1996-04-02 US disclosed