SCHEMBL7611963

SCHEMBL7611963

CC(C)c1cc(Cl)cc(C(C)C)c1NC(=O)NS(=O)(=O)c1cc(CCO)cc(C(F)(F)F)c1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 6/20 0.56
FBP1 P09467 1/20 0.38
ACLY P53396 1/20 0.37
S1PR5 Q9H228 1/20 0.35
GSTO1 P78417 1/20 0.35

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
SCHEMBL7145692 0.84 NLRP3 (0.60) NLRP3ACLYGSTO1
SCHEMBL7138916 0.83 NLRP3 (0.67) NLRP3ACLYGSTO1
SCHEMBL19519038 0.77 NLRP3 (0.78) NLRP3FBP1GSTO1
SCHEMBL7614951 0.77 NLRP3 (0.59) NLRP3FBP1GSTO1
SCHEMBL19518818 0.76 NLRP3 (0.72) NLRP3GSTO1
SCHEMBL30406478 0.76 NLRP3 (0.72) NLRP3GSTO1
SCHEMBL19518827 0.73 NLRP3 (0.69) NLRP3FBP1GSTO1
SCHEMBL7142139 0.73 NLRP3 (0.79) NLRP3FBP1
SCHEMBL7137692 0.73 NLRP3 (0.61) NLRP3FBP1
SCHEMBL20636322 0.73 NLRP3 (0.52) NLRP3GSTO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1214087-A1 COMBINATION TREATMENT WITH IL-1RA AND COMPOUNDS THAT INHIBIT IL-1 PROCESSING AND RELEASE Pfizer Products Inc. (US) 2002-06-19 EP disclosed
WO-2001019390-A1 COMBINATION TREATMENT WITH IL-1RA AND DIARYL SULPHONYL UREA COMPOUNDS PFIZER PRODUCTS INC. (US) 2001-03-22 WO disclosed