SCHEMBL6563189

SCHEMBL6563189

Nc1ccccc1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.62
CA12 O43570 2/20 0.62
CA9 Q16790 2/20 0.62
CRHBP P24387 1/20 0.56
CRHR2 Q13324 1/20 0.56
NFKBIA P25963 1/20 0.56
RELA Q04206 1/20 0.56
CA1 P00915 3/20 0.55
MAPT P10636 3/20 0.54
MAPK1 P28482 3/20 0.54
KMT2A Q03164 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
MEN1 O00255 1/20 0.54
LMNA P02545 1/20 0.54
FFAR4 Q5NUL3 2/20 0.52
HPGD P15428 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
MMP1 P03956 1/20 0.51
MMP2 P08253 1/20 0.51
MMP9 P14780 1/20 0.51

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
SCHEMBL5595350 0.85 DDX3X (0.71) CA2CRHBPCRHR2NFKBIARELA
SCHEMBL7897512 0.85 CRHBP (0.68) CA2CA12CA9CRHBPCRHR2
SCHEMBL11056416 0.84 CRHBP (0.71) CA2CA12CA9CRHBPCRHR2
SCHEMBL3778258 0.82 CA2 (0.68) CA2CA12CA9CRHBPCRHR2
SCHEMBL30737452 0.81 ALDH1A1 (0.58) CA2CA12CA9NFKBIACA1
SCHEMBL2068236 0.81 ALDH1A1 (0.58) CA2CA12CA9NFKBIACA1
SCHEMBL1970882 0.81 CRHBP (0.72) CA2CA12CA9CRHBPCRHR2
SCHEMBL18023815 0.81 DDX3X (0.74) CA2CA12CA9CRHBPCRHR2
SCHEMBL21893366 0.81 CA2 (0.62) CA2CA12CA9CRHBPCRHR2
SCHEMBL2241124 0.81 ALDH1A1 (0.65) CA2CA12CA9CRHBPCRHR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0990645-B1 NOVEL SULFONAMIDE DERIVATIVES NIPPON KAYAKU KK (JP) 2004-07-28 EP disclosed
US-6458960-B1 ANTICANCER AGENTS, RHEUMATIC DISEASES AND ANTIINFLAMMATORY AGENTS NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2002-10-01 US disclosed
US-6180796-B1 TUBULIN POLYMERIZATION INHIBITORS NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2001-01-30 US disclosed
EP-0990645-A1 NOVEL SULFONAMIDE DERIVATIVES Nippon Kayaku Kabushiki Kaisha (JP) 2000-04-05 EP disclosed
EP-0472053-B1 Sulfonamide derivatives EISAI CO LTD (JP) 1998-06-17 EP disclosed
CN-1036650-C process for the preparation of sulfonamide derivatives EISAI CO LTD (JP) 1997-12-10 CN disclosed
US-5610304-A Pyrimidinyl or pyridinyl sulfonamide substituted compounds EISAI CO., LTD. (JP) 1997-03-11 US disclosed
US-5610320-A ANTITUMOR AGENTS EISAI CO., LTD. (JP) 1997-03-11 US disclosed
CN-1136036-A Sulfonamide derivatives EISAI CO LTD (JP) 1996-11-20 CN disclosed
US-5434172-A Antitumor EISAI CO., LTD. (JP) 1995-07-18 US disclosed
US-5332751-A Antitumor EISAI CO., LTD. (JP) 1994-07-26 US disclosed
US-5292758-A Sulfonamide derivatives EISAI CO., LTD. (JP) 1994-03-08 US disclosed
US-5250549-A Antitumor agents EISAI CO., LTD. (JP) 1993-10-05 US disclosed
EP-0472053-A2 Sulfonamide derivatives Eisai Co., Ltd. (JP) 1992-02-26 EP disclosed