SCHEMBL7301268

SCHEMBL7301268

O=S(=O)(c1[c]ccc(F)c1)N1CCOCC1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.50
TSHR P16473 1/20 0.50
POLB P06746 2/20 0.49
ALDH1A1 P00352 2/20 0.47
TDO2 P48775 1/20 0.45
LMNA P02545 3/20 0.45
PKM P14618 1/20 0.45
CASP1 P29466 1/20 0.44
HTT P42858 1/20 0.44
HSD17B10 Q99714 1/20 0.44
MAPK1 P28482 1/20 0.44
CNR1 P21554 1/20 0.44
MEN1 O00255 1/20 0.44
GAA P10253 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL4164080 0.84 USP2 (0.50) SMN1; SMN2TSHRPOLBALDH1A1LMNA
SCHEMBL7309950 0.79 TSHR (0.57) SMN1; SMN2TSHRPOLBALDH1A1LMNA
SCHEMBL28902105 0.77 KMT2A (0.55) SMN1; SMN2POLBALDH1A1LMNAHTT
SCHEMBL7303376 0.77 TSHR (0.48) SMN1; SMN2TSHRPOLBALDH1A1LMNA
SCHEMBL7305589 0.77 SMN1; SMN2 (0.44) SMN1; SMN2TSHRPOLBALDH1A1LMNA
SCHEMBL1855017 0.76 KMT2A (0.51) SMN1; SMN2TSHRPOLBALDH1A1LMNA
SCHEMBL29483599 0.75 PKM (0.66) SMN1; SMN2TSHRPOLBALDH1A1LMNA
SCHEMBL2769910 0.74 POLB (0.73) SMN1; SMN2TSHRPOLBALDH1A1LMNA
SCHEMBL7312262 0.74 TSHR (0.51) SMN1; SMN2TSHRPOLBALDH1A1LMNA
SCHEMBL6638827 0.73 TSHR (0.57) SMN1; SMN2TSHRPOLBALDH1A1LMNA

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-5371074-A Use of saccharin derivatives as proteolytic enzyme inhibitors STERLING WINTHROP INC. (US) 1994-12-06 US claimed
EP-0542372-A1 2-Substituted saccharin derivative proteolytic enzyme inhibitors STERLING WINTHROP INC. (US) 1993-05-19 EP claimed
US-5773456-A EMPHYSEMA, RHEUMATOID ARTHRITIS AND PANCREATITIS SANOFI (FR) 1998-06-30 US disclosed
US-5578623-A DRUGS FOR TREATMENT OF ARTHRITIS, PANCREATITIS, CYSTIC FIBROSIS, BRONCHITIS, RESPIRATORY DISORDERS STERLING WINTHROP INC. (US) 1996-11-26 US disclosed
US-5464852-A Used in treatment of degenerative diseases STERLING WINTHROP INC. (US) 1995-11-07 US disclosed
US-5380737-A Enzyme inhibitors STERLING WINTHROP INC. (US) 1995-01-10 US disclosed
EP-0542371-A1 Saccharin derivative proteolytic enzyme inhibitors STERLING WINTHROP INC. (US) 1993-05-19 EP disclosed