SCHEMBL7308952

SCHEMBL7308952

O=S(=O)(c1[c]c(Cl)cc(Cl)c1)N1CCOCC1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
POLB P06746 2/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
LMNA P02545 3/20 0.42
ALDH1A1 P00352 1/20 0.42
KMT2A Q03164 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MEN1 O00255 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
SCHEMBL7305589 0.72 SMN1; SMN2 (0.44) TSHRPOLBSMN1; SMN2LMNAALDH1A1
SCHEMBL3279364 0.69 TSHR (0.54) TSHRPOLBSMN1; SMN2LMNAALDH1A1
SCHEMBL13404413 0.69 SMN1; SMN2 (0.55) TSHRPOLBSMN1; SMN2LMNAALDH1A1
SCHEMBL5307467 0.68 POLB (0.73) POLBSMN1; SMN2LMNAALDH1A1KMT2A
SCHEMBL6422603 0.68 ALDH1A1 (0.73) TSHRSMN1; SMN2LMNAALDH1A1KMT2A
SCHEMBL7312862 0.68 POLB (0.53) TSHRPOLBSMN1; SMN2LMNAALDH1A1
SCHEMBL5915275 0.67 POLB (0.71) POLBSMN1; SMN2LMNAALDH1A1KMT2A
SCHEMBL10867673 0.66 ACP1 (0.31)
SCHEMBL7309460 0.66 KDM4E (0.59) TSHRSMN1; SMN2LMNAALDH1A1KMT2A
SCHEMBL16733792 0.66 OPRM1 (0.50) TSHRPOLBSMN1; SMN2LMNAALDH1A1

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
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