SCHEMBL7208070

SCHEMBL7208070

CC(C)(O)c1coc(S(N)(=O)=O)c1.CC(C)c1cccc(C(C)C)c1N=C=O

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 8/20 0.53
CA2 P00918 7/20 0.33
CA12 O43570 2/20 0.32
CA1 P00915 2/20 0.32
CA9 Q16790 2/20 0.32
HSD11B1 P28845 1/20 0.32
CDK1 P06493 1/20 0.30
CCNA2 P20248 1/20 0.30
CDK2 P24941 1/20 0.30

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
SCHEMBL6869002 0.77 NLRP3 (0.45) NLRP3CA2
SCHEMBL7612982 0.76 NLRP3 (0.90) NLRP3CA2
SCHEMBL27430354 0.75 NLRP3 (0.44) NLRP3CA2
SCHEMBL191769 0.71 GABRA1 (0.50) CA2CA1
SCHEMBL6553324 0.69 NLRP3 (1.00) NLRP3CA2
SCHEMBL25033765 0.68 NLRP3 (0.71) NLRP3CA2
SCHEMBL7618158 0.67 NLRP3 (0.35) NLRP3CA2
Carbimide SCHEMBL29047475 0.67 GABRA1 (0.46) CA2CA1
Sulfanilamide SCHEMBL7658884 0.65 CA2 (0.42) NLRP3CA2CA12CA1CA9
SCHEMBL7622275 0.65 NLRP3 (0.33) NLRP3

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
EP-0964849-B1 SULFONYL UREA DERIVATIVES AND THEIR USE IN THE CONTROL OF INTERLEUKIN-1 ACTIVITY PFIZER (US) 2003-06-04 EP disclosed