SCHEMBL6958970

SCHEMBL6958970

[O]CN1C(=O)c2ccccc2S1(=O)=O

nearest known ligand 0.71

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CA12 O43570 18/20 0.71
CA9 Q16790 17/20 0.71
ELANE P08246 1/20 0.71
CA2 P00918 5/20 0.65
CA1 P00915 2/20 0.61

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
SCHEMBL7290946 0.87 CA12 (0.69) CA12CA9ELANECA2CA1
SCHEMBL356403 0.83 CA12 (0.69) CA12CA9ELANECA2
SCHEMBL30834902 0.83 CA12 (1.00) CA12CA9ELANECA2CA1
SCHEMBL30657571 0.83 CA12 (0.69) CA12CA9ELANECA2CA1
SCHEMBL5899155 0.83 ELANE (1.00) CA12CA9ELANECA2CA1
SCHEMBL8865776 0.83 CA12 (0.69) CA12CA9ELANECA2CA1
SCHEMBL7281348 0.83 CA12 (0.69) CA12CA9ELANECA2CA1
SCHEMBL1101896 0.83 CA12 (1.00) CA12CA9ELANECA2CA1
SCHEMBL7290973 0.83 CA12 (0.69) CA12CA9ELANECA2CA1
SCHEMBL7932914 0.82 CA9 (0.74) CA12CA9ELANECA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0848004-B1 PYRROLIDINE DERIVATIVES HAVING PHOSPHOLIPASE A2 INHIBITORY ACTIVITY SHIONOGI & CO (JP) 2003-04-02 EP claimed
EP-0848004-B1 PYRROLIDINE DERIVATIVES HAVING PHOSPHOLIPASE A2 INHIBITORY ACTIVITY SHIONOGI & CO (JP) 2003-04-02 EP disclosed
US-5955616-A PROSTAGLANDIN INHIBITORS SHIONOGI & CO., LTD. (JP) 1999-09-21 US disclosed
EP-0848004-A1 PYRROLIDINE DERIVATIVES HAVING PHOSPHOLIPASE A2 INHIBITORY ACTIVITY SHIONOGI & CO., LTD. (JP) 1998-06-17 EP disclosed