SCHEMBL7499622

SCHEMBL7499622

Cc1ccc2cc(S(N)(=O)=O)ccc2c1C(=O)c1ccc(F)cc1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.48
PTGS2 P35354 1/20 0.48
MAOA P21397 1/20 0.46
CA1 P00915 9/20 0.43
CA2 P00918 9/20 0.43
CA9 Q16790 8/20 0.43
CA12 O43570 3/20 0.43
CA7 P43166 2/20 0.43
CA14 Q9ULX7 1/20 0.43
CA4 P22748 5/20 0.42
MAPT P10636 1/20 0.42
MAPK1 P28482 1/20 0.42
ACHE P22303 1/20 0.40
KDM4E B2RXH2 1/20 0.39
NPC1 O15118 1/20 0.39
POLB P06746 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL7498185 0.88 PTGS2 (0.62) PTGS1PTGS2
SCHEMBL7502762 0.87 MAOA (0.48) PTGS1PTGS2MAOACA1CA2
SCHEMBL7499610 0.85 MAOA (0.46) PTGS1PTGS2MAOACA1CA2
SCHEMBL7505272 0.84 MEN1 (0.47) PTGS1PTGS2MAOACA1CA2
SCHEMBL7496347 0.81 MAOA (0.43) PTGS1PTGS2MAOACA1CA2
SCHEMBL7501856 0.81 LMNA (0.42) PTGS1PTGS2CA1CA2CA9
SCHEMBL7499348 0.78 PTGS2 (0.58) PTGS1PTGS2
SCHEMBL7494744 0.78 MAPT (0.40) PTGS1PTGS2MAOACA1CA2
SCHEMBL806809 0.77 LTA4H (0.47) PTGS1PTGS2CA1CA2MAPT
SCHEMBL7506276 0.75 GAA (0.45) PTGS1PTGS2CA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0966437-B1 5-AROYLNAPHTHALENE DERIVATIVES HOFFMANN LA ROCHE (CH) 2002-06-12 EP disclosed
US-6150397-A 5-(PYRIDYL, FURYL, OR THIENYL SUBSTITUTED)-6-SUBSTITUTED-2--2-NAPHTHALENESULFONAMIDES OF GIVEN FORMULA; INHIBITORS OF PROSTAGLANDIN G/H SYNTHASE; TREATING INFLAMMATORY DISEASE SUCH AS GOUT, ARTHRITIS, MYOSITIS, SYNOVITIS SYNTEX (U.S.A.) INC. (US) 2000-11-21 US disclosed
EP-0966437-A1 5-AROYLNAPHTHALENE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 1999-12-29 EP disclosed
US-5962531-A PROSTAGLANDIN SYNTHASE INHIBITOR; RHEUMATIC DISORDERS SYNTEX (U.S.A.) INC. (US) 1999-10-05 US disclosed
WO-1998032732-A1 5-AROYLNAPHTHALENE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1998-07-30 WO disclosed