SCHEMBL6945975

SCHEMBL6945975

CNC(=O)C1CC(OCC2CC2)CN1S(=O)(=O)c1ccc(Cl)c(CBr)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 1/20 0.41
RORC P51449 17/20 0.40
BDKRB2 P30411 1/20 0.38
BDKRB1 P46663 1/20 0.38
HCRTR1 O43613 1/20 0.32
HCRTR2 O43614 1/20 0.32

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
SCHEMBL6945980 1.00 MMP9 (0.41) MMP9RORCBDKRB2BDKRB1HCRTR1
SCHEMBL7648412 0.91 MMP9 (0.42) MMP9RORCBDKRB2BDKRB1
SCHEMBL7648416 0.91 MMP9 (0.42) MMP9RORCBDKRB2BDKRB1
SCHEMBL6945183 0.89 MMP9 (0.43) MMP9RORC
SCHEMBL6945180 0.89 MMP9 (0.43) MMP9RORC
SCHEMBL6936907 0.89 RORC (0.40) MMP9RORCBDKRB2BDKRB1
SCHEMBL6941442 0.89 RORC (0.40) MMP9RORCBDKRB2BDKRB1
SCHEMBL6936904 0.89 RORC (0.40) MMP9RORCBDKRB2BDKRB1
SCHEMBL6942565 0.87 RORC (0.41) MMP9RORCBDKRB2BDKRB1
SCHEMBL6942563 0.87 RORC (0.41) MMP9RORCBDKRB2BDKRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1155013-B1 HETEROCYCLIC BENZENESULPHONAMIDE COMPOUNDS AS BRADYKININE ANTAGONISTS FOURNIER IND & SANTE (FR) 2003-07-23 EP disclosed
US-6479515-B1 FOR THE TREATMENT OF PAIN AND INFLAMMATION, AND ESPECIALLY IN THE TREATMENT OF ASTHMA, CEREBRAL TRAUMATIC SHOCK AND ALLERGIC RHINITIS FOURNIER INDUSTRIE ET SANTE (FR) 2002-11-12 US disclosed
WO-2000050418-A9 HETEROCYCLIC BENZENESULPHONAMIDE COMPOUNDS AS BRADYKININE ANTAGONISTS FOURNIER IND & SANTE (FR) 2001-02-22 WO disclosed