SCHEMBL7012787

SCHEMBL7012787

Cc1nc2c(OCc3c(Cl)ccc(S(=O)(=O)N4CCC[C@H]4C(=O)NCc4ccc(C=NN)cc4)c3Cl)cccn2c1Br

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RORC P51449 7/20 0.50
BDKRB2 P30411 5/20 0.50

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
Hydrochloric Acid SCHEMBL7715540 0.99 BDKRB2 (0.51) RORCBDKRB2
SCHEMBL7012298 0.94 RORC (0.51) RORCBDKRB2
Hydrochloric Acid SCHEMBL7719755 0.93 RORC (0.51) RORCBDKRB2
SCHEMBL7008622 0.90 BDKRB2 (0.59) RORCBDKRB2
SCHEMBL7012777 0.90 BDKRB2 (0.59) RORCBDKRB2
Hydrochloric Acid SCHEMBL7722642 0.90 BDKRB2 (0.58) RORCBDKRB2
Hydrochloric Acid SCHEMBL7715532 0.89 BDKRB2 (0.59) RORCBDKRB2
SCHEMBL7010687 0.87 RORC (0.48) RORCBDKRB2
Hydrochloric Acid SCHEMBL7722636 0.86 RORC (0.48) RORCBDKRB2
SCHEMBL7015007 0.85 BDKRB2 (0.55) 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