SCHEMBL7309320

SCHEMBL7309320

C=CCc1cc(OCC)c2c(c1OC)S(=O)(=O)N(Cc1ccccc1)C2=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.44
ALDH1A1 P00352 4/20 0.44
GAA P10253 3/20 0.44
L3MBTL1 Q9Y468 3/20 0.44
HPGD P15428 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
PTPN1 P18031 1/20 0.39
ELANE P08246 4/20 0.37
LMNA P02545 1/20 0.36
CA12 O43570 1/20 0.36
CA9 Q16790 1/20 0.36
HTT P42858 1/20 0.35
KDM4E B2RXH2 2/20 0.34
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
POLB P06746 2/20 0.33
NR2E3 Q9Y5X4 1/20 0.33
P2RX7 Q99572 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33

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
SCHEMBL7314650 0.88 GAA (0.42) MAPTALDH1A1GAAL3MBTL1HPGD
SCHEMBL7306464 0.79 MAPT (0.40) MAPTALDH1A1GAAL3MBTL1HPGD
SCHEMBL7304861 0.74 ELANE (0.37) ALDH1A1ELANEHTTKDM4EMEN1
SCHEMBL7305007 0.73 MAPT (0.43) MAPTALDH1A1GAAL3MBTL1ELANE
SCHEMBL7288293 0.72 ELANE (0.54) MAPTALDH1A1GAAL3MBTL1TDP1
SCHEMBL7278186 0.71 ALDH1A1 (0.42) MAPTALDH1A1GAAL3MBTL1TDP1
Ammonia Solution, Strong SCHEMBL27564485 0.70 CA12 (0.47) GAAL3MBTL1TDP1CA12CA9
SCHEMBL7314724 0.67 ELANE (0.66) ELANE
SCHEMBL7312138 0.67 ELANE (0.38) MAPTALDH1A1L3MBTL1HPGDTDP1
SCHEMBL7280180 0.66 ELANE (0.43) MAPTALDH1A1GAAL3MBTL1HPGD

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