SCHEMBL7014640

SCHEMBL7014640

CC(=O)ON=C(N)c1ccc(C(=O)N2CCN(C(=O)[C@@H]3CCCN3S(=O)(=O)c3ccc(Cl)c(COc4cccn5c(=O)cc(C)nc45)c3Cl)CC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RORC P51449 18/20 0.51
BDKRB2 P30411 2/20 0.46

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
SCHEMBL7008416 0.93 RORC (0.53) RORCBDKRB2
SCHEMBL7018105 0.91 RORC (0.49) RORCBDKRB2
SCHEMBL7018107 0.91 RORC (0.49) RORCBDKRB2
SCHEMBL7008057 0.91 RORC (0.49) RORCBDKRB2
SCHEMBL7008059 0.91 RORC (0.49) RORCBDKRB2
SCHEMBL7012584 0.91 BDKRB2 (0.55) RORCBDKRB2
SCHEMBL7015868 0.90 RORC (0.50) RORCBDKRB2
SCHEMBL7015869 0.90 RORC (0.50) RORCBDKRB2
SCHEMBL7014875 0.88 RORC (0.51) RORCBDKRB2
SCHEMBL7014798 0.87 BDKRB2 (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 6 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-1054882-A1 CONDENSED HETEROCYCLIC SYSTEM DERIVATIVES, PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Aventis Pharma S.A. (FR) 2000-11-29 EP 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-1999041248-A1 CONDENSED HETEROCYCLIC SYSTEM DERIVATIVES, PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AVENTIS PHARMA S.A. (FR) 1999-08-19 WO 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