SCHEMBL7013227

SCHEMBL7013227

Cc1cn2cccc(OCc3c(Cl)ccc(S(=O)(=O)N4CCC[C@H]4C(=O)N4CCN(C(=O)c5ccc(C=NN)cc5)CC4)c3Cl)c2n1

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RORC P51449 17/20 0.49
BDKRB2 P30411 2/20 0.44

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
SCHEMBL7719768 0.98 RORC (0.48) RORCBDKRB2
SCHEMBL7008852 0.91 RORC (0.51) RORCBDKRB2
SCHEMBL7008857 0.91 RORC (0.51) RORCBDKRB2
SCHEMBL7013218 0.91 BDKRB2 (0.54) RORCBDKRB2
SCHEMBL7013222 0.91 BDKRB2 (0.54) RORCBDKRB2
SCHEMBL7015868 0.89 RORC (0.50) RORCBDKRB2
SCHEMBL7015869 0.89 RORC (0.50) RORCBDKRB2
SCHEMBL7719765 0.89 BDKRB2 (0.54) RORCBDKRB2
SCHEMBL7007123 0.89 RORC (0.49) RORCBDKRB2
SCHEMBL7719760 0.89 BDKRB2 (0.54) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0991650-B1 NOVEL N-BENZENESULPHONYL-L-PROLINE COMPOUNDS, PREPARATION METHOD AND USE IN THERAPY FOURNIER IND & SANTE (FR) 2003-09-10 EP disclosed
US-6384222-B1 BRADYKININ HORMONE ANTAGONIST; ANALGESIC, ANTIINFLAMMATORY; ASTHMA, CEREBRAL TRAUMATIC SHOCK AND ALLERGIC RHINITIS; ETHERIFICATION, AMIDATION FOURNIER INDUSTRIE ET SANTE (FR) 2002-05-07 US disclosed
EP-0991650-A1 NOVEL N-BENZENESULPHONYL-L-PROLINE COMPOUNDS, PREPARATION METHOD AND USE IN THERAPY FOURNIER INDUSTRIE ET SANTE (FR) 2000-04-12 EP disclosed
WO-1999000387-A1 NOVEL N-BENZENESULPHONYL-L-PROLINE COMPOUNDS, PREPARATION METHOD AND USE IN THERAPY FOURNIER INDUSTRIE ET SANTE (FR) 1999-01-07 WO disclosed