SCHEMBL9819445

SCHEMBL9819445

CSc1cccc(S(N)(=O)=O)c1S(N)(=O)=O

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA2 P00918 12/20 0.47
CA1 P00915 11/20 0.47
CA9 Q16790 9/20 0.47
CA12 O43570 5/20 0.47
CA14 Q9ULX7 3/20 0.47
PTGES2 Q9H7Z7 2/20 0.44
CA6 P23280 3/20 0.41
CA5A P35218 3/20 0.41
CA4 P22748 2/20 0.41
CA7 P43166 2/20 0.41
CA5B Q9Y2D0 2/20 0.41
CYP2C9 P11712 1/20 0.41
CDK2 P24941 1/20 0.40
ALDH1A1 P00352 2/20 0.37
MAPK1 P28482 1/20 0.37
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
STAT3 P40763 1/20 0.36

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
SCHEMBL6729025 0.88 CA2 (0.44) CA2CA1CA9CA12CA14
SCHEMBL2226182 0.82 CA2 (0.56) CA2CA1CA9CA12CA14
SCHEMBL9492408 0.80 CA2 (0.55) CA2CA1CA9CA12CA14
SCHEMBL3770101 0.79 CA1 (0.39) CA2CA1CA9CA12CA14
SCHEMBL6730193 0.79 KMT2A (0.41) CA2CA1CA9CA12CA14
SCHEMBL6734275 0.79 PTGES2 (0.46) CA2CA1CA9CA12CA14
SCHEMBL6823501 0.76 PTGES2 (0.47) CA2CA1CA9CA12CA14
SCHEMBL6823506 0.75 ALDH1A1 (0.41) CA2CA1CA9CA12CA14
SCHEMBL1925949 0.74 CA2 (0.45) CA2CA1CA9CA12CA14
SCHEMBL7029403 0.72 CA2 (0.54) CA2CA1CA9CA12CA5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0404758-A1 HERBICIDAL SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-01-02 EP disclosed
EP-0404758-A4 HERBICIDAL SULFONAMIDES. DU PONT (US) 1989-08-30 EP disclosed
US-4854962-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1989-08-08 US disclosed
US-4746356-A Herbicidal sulfonamides E. I. DUPONT DE NEMOURS AND COMPANY (US) 1988-05-24 US disclosed
WO-1987007114-A1 HERBICIDAL SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1987-12-03 WO disclosed