SCHEMBL7614941

SCHEMBL7614941

COc1ccc(S(=O)(=O)NC(=O)Nc2c(C(C)C)cccc2C(C)C)cc1C(C)=O.COc1ccc(S(N)(=O)=O)cc1C(C)=O

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 6/20 0.58
LPAR1 Q92633 5/20 0.47

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
SCHEMBL7137337 0.95 NLRP3 (0.64) NLRP3LPAR1
SCHEMBL7619278 0.90 NLRP3 (0.54) NLRP3LPAR1
SCHEMBL7617320 0.88 NLRP3 (0.60) NLRP3
SCHEMBL7145367 0.85 NLRP3 (0.59) NLRP3LPAR1
SCHEMBL7136055 0.83 NLRP3 (0.65) NLRP3
SCHEMBL7140501 0.83 NLRP3 (0.75) NLRP3
SCHEMBL7616971 0.81 NLRP3 (0.66) NLRP3
SCHEMBL7618626 0.81 NLRP3 (0.52) NLRP3
SCHEMBL7614942 0.79 NLRP3 (0.69) NLRP3
SCHEMBL7618689 0.78 NLRP3 (0.48) NLRP3LPAR1

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