SCHEMBL7614951

SCHEMBL7614951

CC(C)c1cc(Cl)cc(C(C)C)c1NC(=O)NS(=O)(=O)c1ccc(F)c(CCO)c1

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 5/20 0.59
GSTO1 P78417 1/20 0.43
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
TSHR P16473 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
FBP1 P09467 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
SCHEMBL7137701 0.83 NLRP3 (0.69) NLRP3GSTO1ALDH1A1LMNATSHR
SCHEMBL7135756 0.82 NLRP3 (0.62) NLRP3GSTO1ALDH1A1LMNATSHR
SCHEMBL18029590 0.78 NLRP3 (0.79) NLRP3MEN1KMT2AFBP1
SCHEMBL31135852 0.78 NLRP3 (0.79) NLRP3MEN1KMT2AFBP1
SCHEMBL18029610 0.78 NLRP3 (0.68) NLRP3FBP1
SCHEMBL7613834 0.78 NLRP3 (0.57) NLRP3GSTO1ALDH1A1LMNATSHR
SCHEMBL7611963 0.77 NLRP3 (0.56) NLRP3GSTO1FBP1
SCHEMBL7140940 0.76 NLRP3 (0.69) NLRP3KMT2AFBP1
SCHEMBL6555763 0.76 NLRP3 (0.76) NLRP3FBP1
SCHEMBL7137330 0.76 NLRP3 (0.76) NLRP3FBP1

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