SCHEMBL4668319

SCHEMBL4668319

Cc1cccc(OC(C)C)c1.O=S(=O)(O)Cl

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.54
RXRA P19793 1/20 0.45
RXRB P28702 1/20 0.45
RECQL P46063 1/20 0.45
ACHE P22303 1/20 0.44
KAT6A Q92794 1/20 0.44
CA2 P00918 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
HTT P42858 2/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
GAA P10253 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MAPT P10636 2/20 0.42
TP53 P04637 1/20 0.42
ALOX5 P09917 1/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL27469399 0.93 LMNA (0.53) LMNARXRARXRBRECQLACHE
SCHEMBL12006 0.86 LMNA (0.59) LMNARXRARXRBACHESMN1; SMN2
Bromide SCHEMBL27571347 0.84 LMNA (0.57) LMNARXRARXRBACHESMN1; SMN2
SCHEMBL27512374 0.82 LMNA (0.56) LMNARXRARXRBACHESMN1; SMN2
SCHEMBL27298212 0.78 LMNA (0.47) LMNARECQLACHESMN1; SMN2HTT
SCHEMBL7161209 0.77 TDP1 (0.51) LMNARXRARXRBACHESMN1; SMN2
SCHEMBL7468235 0.76 ELANE (0.52) CA2SMN1; SMN2HTTKMT2AMEN1
SCHEMBL28872457 0.76 LMNA (0.53) LMNARECQLACHESMN1; SMN2KMT2A
SCHEMBL30360621 0.76 LMNA (0.53) LMNARECQLACHESMN1; SMN2KMT2A
SCHEMBL18210776 0.75 RXRA (0.58) LMNARXRARXRBACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0885200-B1 SUBSTITUTED ARYL SULPHONYL(THIO)UREAS USED AS HERBICIDES BAYER CROPSCIENCE AG (DE) 2008-05-21 EP disclosed
EP-1683789-A1 Substituted arylsulfonyl(thio)ureas as herbicides Bayer CropScience AG (DE) 2006-07-26 EP disclosed
EP-1344771-A1 2-alkoxy-phenylsulphonic acid derivatives as intermediates for herbicidal sulphonylamino(thio)carbonyl compounds Bayer CropScience AG (DE) 2003-09-17 EP disclosed
EP-0842157-B1 HERBICIDAL SULPHONYLAMINO(THIO)CARBONYL COMPOUNDS BAYER CROPSCIENCE AG (DE) 2003-08-27 EP disclosed
EP-0885200-A1 SUBSTITUTED ARYL SULPHONYL(THIO)UREAS USED AS HERBICIDES BAYER AG (DE) 1998-12-23 EP disclosed
EP-0842157-A1 HERBICIDAL SULPHONYLAMINO(THIO)CARBONYL COMPOUNDS BAYER AG (DE) 1998-05-20 EP disclosed
WO-1997032861-A1 SUBSTITUTED ARYL SULPHONYL(THIO)UREAS USED AS HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-09-12 WO disclosed
WO-1997003056-A1 HERBICIDAL SULPHONYLAMINO(THIO)CARBONYL COMPOUNDS BAYER AKTIENGESELLSCHAFT (DE) 1997-01-30 WO disclosed