SCHEMBL7448574

SCHEMBL7448574

CC(C)c1cc(OCCC(C)(C)C(=O)OCc2ccccc2)cc2c1C(=O)N(C(=O)c1cc(C(F)(F)F)nn1-c1ccccc1)S2(=O)=O

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 7/20 0.38
ELANE P08246 6/20 0.38
KLKB1 P03952 3/20 0.34

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
SCHEMBL7448570 0.86 ELANE (0.42) ELANE
SCHEMBL7407090 0.85 CARM1 (0.35) CARM1ELANE
SCHEMBL8615757 0.76 ELANE (0.33) ELANE
SCHEMBL8614366 0.75 ELANE (0.43) ELANE
SCHEMBL8614493 0.74 ELANE (0.42) ELANE
SCHEMBL7407088 0.71 ELANE (0.41) ELANE
SCHEMBL8615682 0.69 ELANE (0.45) ELANE
SCHEMBL7408952 0.69 ELANE (0.33) ELANE
SCHEMBL7404663 0.69 ELANE (0.35) ELANE
SCHEMBL8614058 0.67 ELANE (0.57) ELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1997010243-A1 2-(PYRAZOL-5-YL-OXYMETHYL)-1,2-BENZISOTHIAZOL-3(2H)-ONE 1,1-DIOXIDES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SANOFI (US) 1997-03-20 WO disclosed