SCHEMBL6938693

SCHEMBL6938693

Cc1cc(-n2cncn2)c2cccc(OCc3c(Cl)ccc(S(=O)(=O)OC(=O)[C@@H]4CCCN4)c3Cl)c2n1

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RORC P51449 18/20 0.51
BDKRB2 P30411 2/20 0.48

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
SCHEMBL6942965 0.90 BDKRB2 (0.54) RORCBDKRB2
SCHEMBL6945241 0.88 RORC (0.66) RORCBDKRB2
SCHEMBL6944540 0.88 RORC (0.66) RORCBDKRB2
SCHEMBL6946095 0.87 BDKRB2 (0.53) RORCBDKRB2
SCHEMBL6938687 0.81 RORC (0.73) RORCBDKRB2
SCHEMBL8181783 0.80 BDKRB2 (0.47) RORCBDKRB2
SCHEMBL6943370 0.78 RORC (0.65) RORCBDKRB2
SCHEMBL7129529 0.76 RORC (0.63) RORCBDKRB2
SCHEMBL6945941 0.76 RORC (0.66) RORCBDKRB2
SCHEMBL7129525 0.76 RORC (0.63) RORCBDKRB2

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 5 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
EP-1155013-A1 HETEROCYCLIC BENZENESULPHONAMIDE COMPOUNDS AS BRADYKININE ANTAGONISTS FOURNIER INDUSTRIE ET SANTE (FR) 2001-11-21 EP disclosed
WO-2000050418-A9 HETEROCYCLIC BENZENESULPHONAMIDE COMPOUNDS AS BRADYKININE ANTAGONISTS FOURNIER IND & SANTE (FR) 2001-02-22 WO disclosed
WO-2000050418-A1 HETEROCYCLIC BENZENESULPHONAMIDE COMPOUNDS AS BRADYKININE ANTAGONISTS FOURNIER INDUSTRIE ET SANTE (FR) 2000-08-31 WO disclosed