SCHEMBL5399765

SCHEMBL5399765

COc1cccc(F)c1S(N)(=O)=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGES2 Q9H7Z7 3/20 0.54
CA2 P00918 6/20 0.45
CA1 P00915 4/20 0.44
ACHE P22303 2/20 0.44
PTGS2 P35354 3/20 0.43
PTGS1 P23219 2/20 0.43
KAT6A Q92794 1/20 0.42
CA12 O43570 2/20 0.42
CA9 Q16790 2/20 0.42
LMNA P02545 2/20 0.41
KMT2A Q03164 2/20 0.41
MAPK1 P28482 2/20 0.41
PKM P14618 1/20 0.41
PKLR P30613 1/20 0.41
GAA P10253 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NFE2L2 Q16236 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KDM4E B2RXH2 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
SCHEMBL30586500 1.00 PTGES2 (0.54) PTGES2CA2CA1ACHEPTGS2
SCHEMBL6807395 0.86 CA2 (0.51) PTGES2CA2CA1ACHEPTGS1
SCHEMBL24429780 0.81 KAT6A (0.42) PTGES2CA2CA1ACHEKAT6A
SCHEMBL677588 0.80 CA1 (0.52) PTGES2CA2CA1CA12CA9
SCHEMBL1131641 0.79 ALDH1A1 (0.52) PTGES2CA2CA1ACHEPTGS1
SCHEMBL3600104 0.79 CA2 (0.46) PTGES2CA2CA1ACHECA12
SCHEMBL31536843 0.79 CA2 (0.46) PTGES2CA2CA1ACHECA12
SCHEMBL30928578 0.78 PTGS2 (0.49) PTGES2CA2CA1PTGS2PTGS1
SCHEMBL6731762 0.78 CA2 (0.47) PTGES2CA2CA1ACHECA12
SCHEMBL3772307 0.78 CA2 (0.45) PTGES2CA2CA1ACHECA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE39607-E1 Herbicidal sulphonylamino(thio) carbonyl compounds BAYER AKTIENGESELLSCHAFT (DE) 2007-05-01 US disclosed
US-RE39607-E1 Herbicidal sulphonylamino(thio) carbonyl compounds BAYER AKTIENGESELLSCHAFT (DE) 2007-05-01 US disclosed
US-RE39607-E1 Herbicidal sulphonylamino(thio) carbonyl compounds BAYER AKTIENGESELLSCHAFT (DE) 2007-05-01 US 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
US-6525211-B1 Chemical intermediates BAYER AKTIENGESELLSCHAFT (DE) 2003-02-25 US disclosed
CN-1086696-C Sulphonylamino (thio) carbonyl compounds 拜尔公司 2002-06-26 CN disclosed
US-6251831-B1 WITH SUBSTITUTED PHENYL AND SUBSTITUTED 1,2,4-TRIAZOLE MOIETIES; PRE- AND POST-EMERGENCE HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 2001-06-26 US disclosed
EP-0842157-A1 HERBICIDAL SULPHONYLAMINO(THIO)CARBONYL COMPOUNDS BAYER AG (DE) 1998-05-20 EP disclosed
WO-1997003056-A1 HERBICIDAL SULPHONYLAMINO(THIO)CARBONYL COMPOUNDS BAYER AKTIENGESELLSCHAFT (DE) 1997-01-30 WO disclosed