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SCHEMBL7012584

SCHEMBL7012584

Cc1cc(=O)n2cccc(OCc3c(Cl)ccc(S(=O)(=O)N4CCC[C@H]4C(=O)N4CCN(C(=O)c5ccc(C(=N)N)cc5)CC4)c3Cl)c2n1

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ BDKRB2 P30411 2/20 0.55
▸ RORC P51449 18/20 0.54

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) BDKRB2RORC
SCHEMBL7014640 0.91 RORC (0.51) BDKRB2RORC
SCHEMBL7014875 0.91 RORC (0.51) BDKRB2RORC
SCHEMBL7007118 0.91 BDKRB2 (0.52) BDKRB2RORC
SCHEMBL7007117 0.91 BDKRB2 (0.52) BDKRB2RORC
Hydrochloric Acid SCHEMBL7719780 0.90 BDKRB2 (0.52) BDKRB2RORC
Hydrochloric Acid SCHEMBL7719778 0.90 BDKRB2 (0.52) BDKRB2RORC
SCHEMBL7010679 0.89 BDKRB2 (0.51) BDKRB2RORC
SCHEMBL7010675 0.89 BDKRB2 (0.51) BDKRB2RORC
SCHEMBL7013222 0.89 BDKRB2 (0.54) BDKRB2RORC

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 2 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