SCHEMBL7618593

SCHEMBL7618593

CC(C)(O)NS(=O)(=O)c1ccco1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 4/20 0.48
NLRP3 Q96P20 1/20 0.39
ALDH1A1 P00352 2/20 0.35
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
KDM4E B2RXH2 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
HPGD P15428 1/20 0.34
CYP2C19 P33261 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.33
RECQL P46063 1/20 0.33
GAA P10253 1/20 0.33
SGK1 O00141 1/20 0.33

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
SCHEMBL22928020 0.85 CCR2 (0.47) CCR2NLRP3ALDH1A1MEN1KMT2A
SCHEMBL8227599 0.75 CCR2 (0.46) CCR2NLRP3ALDH1A1KDM4ECYP1A2
SCHEMBL13485838 0.75 CA2 (0.45) CCR2NLRP3ALDH1A1MEN1KMT2A
SCHEMBL24806202 0.74 CCR2 (0.43) CCR2NLRP3ALDH1A1MEN1KMT2A
SCHEMBL29813636 0.71 CCR2 (0.46) CCR2NLRP3ALDH1A1MEN1KMT2A
SCHEMBL29813806 0.71 CCR2 (0.43) CCR2NLRP3ALDH1A1MEN1KMT2A
SCHEMBL8062374 0.70 NLRP3 (0.50) CCR2NLRP3ALDH1A1MEN1KMT2A
SCHEMBL13956520 0.70 CCR2 (0.43) CCR2NLRP3ALDH1A1MEN1KMT2A
SCHEMBL29059476 0.70 ALDH1A1 (0.51) CCR2ALDH1A1MEN1KMT2AKDM4E
SCHEMBL8063559 0.69 NLRP3 (0.49) CCR2NLRP3ALDH1A1MEN1KMT2A

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