SCHEMBL7314445

SCHEMBL7314445

O=C1c2ccc(O)cc2S(=O)(=O)N1Cc1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA12 O43570 12/20 0.68
CA9 Q16790 12/20 0.68
RAB9A P51151 1/20 0.64
CA1 P00915 4/20 0.56
HDAC1 Q13547 4/20 0.56
HDAC2 Q92769 4/20 0.56
CA2 P00918 3/20 0.54
KMT2A Q03164 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
GAA P10253 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
SCHEMBL6242464 0.89 CA12 (0.68) CA12CA9RAB9ACA1HDAC1
SCHEMBL29853641 0.84 CA12 (0.48) CA12CA9RAB9ACA1HDAC1
SCHEMBL26768273 0.84 CA12 (0.48) CA12CA9RAB9ACA1HDAC1
SCHEMBL7280334 0.83 CA12 (0.65) CA12CA9RAB9ACA1HDAC1
SCHEMBL7281068 0.83 CA12 (0.68) CA12CA9RAB9ACA1HDAC1
SCHEMBL1172438 0.82 CA12 (1.00) CA12CA9CA1HDAC1HDAC2
SCHEMBL30527996 0.82 CA12 (1.00) CA12CA9CA1HDAC1HDAC2
SCHEMBL7281529 0.80 CA12 (0.72) CA12CA9RAB9ACA1HDAC1
SCHEMBL7299633 0.79 RAB9A (1.00) CA12CA9RAB9ACA1HDAC1
SCHEMBL31658258 0.79 CA12 (0.45) CA12CA9RAB9ACA1HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5874432-A Saccharin derivatives useful as proteolytic enzyme inhibitors and compositions and method of use thereof SANOFI (FR) 1999-02-23 US disclosed
US-5650422-A TREATMENT OF EMPHYSEMA, ARTHRITIS OR PANCREATITIS SANOFI (FR) 1997-07-22 US disclosed
US-5596012-A Saccharin derivatives useful as proteolytic enzyme inhibitors and compositions and method of use thereof STERLING WINTHROP INC. (US) 1997-01-21 US disclosed
US-5371074-A Use of saccharin derivatives as proteolytic enzyme inhibitors STERLING WINTHROP INC. (US) 1994-12-06 US disclosed
US-5236917-A Respiratory system disorders, antiarthritic agents STERLING WINTHROP INC. (US) 1993-08-17 US disclosed
EP-0542372-A1 2-Substituted saccharin derivative proteolytic enzyme inhibitors STERLING WINTHROP INC. (US) 1993-05-19 EP disclosed