SCHEMBL7811448

SCHEMBL7811448

Cc1cc(C)c2cccc(OCc3c(Cl)ccc(S(=O)(=O)N4CCC[C@H]4C(=O)NCc4cccc(C=NN)c4)c3Cl)c2n1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 2/20 0.67
RORC P51449 18/20 0.66

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 SCHEMBL8187368 0.99 BDKRB2 (0.67) BDKRB2RORC
SCHEMBL7811575 0.94 BDKRB2 (0.68) BDKRB2RORC
SCHEMBL8181615 0.93 BDKRB2 (0.67) BDKRB2RORC
SCHEMBL8183473 0.93 BDKRB2 (0.66) BDKRB2RORC
Hydrochloric Acid SCHEMBL8182452 0.92 BDKRB2 (0.65) BDKRB2RORC
SCHEMBL7819031 0.90 BDKRB2 (0.69) BDKRB2RORC
Hydrochloric Acid SCHEMBL8187933 0.90 BDKRB2 (0.69) BDKRB2RORC
SCHEMBL6947379 0.89 BDKRB2 (0.79) BDKRB2RORC
SCHEMBL7815013 0.89 BDKRB2 (0.71) BDKRB2RORC
SCHEMBL6953309 0.89 BDKRB2 (0.80) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0925295-B1 N-BENZENESULPHONYL-L-PROLINE DERIVATIVES AS B2 RECEPTOR ANTAGONISTS OF THE BRADYKININ FOURNIER IND & SANTE (FR) 2001-10-04 EP disclosed
US-6071917-A ANALGESICS; ANTIINFLAMMATORY AGENTS; ESPECIALLY FOR THE TREATMENT OF ASTHMA, CEREBRAL TRAUMATIC SHOCK AND ALLERGIC RHINITIS; COMPETITIVE BINDING AT RECEPTORS FOURNIER INDUSTRIE ET SANTE (FR) 2000-06-06 US disclosed
EP-0925295-A1 N-BENZENESULPHONYL-L-PROLINE DERIVATIVES AS BRADYKININ B2 AGONISTS FOURNIER INDUSTRIE ET SANTE (FR) 1999-06-30 EP disclosed
WO-1998003503-A1 N-BENZENESULPHONYL-L-PROLINE DERIVATIVES AS BRADYKININ B2 AGONISTS FOURNIER INDUSTRIE ET SANTE (FR) 1998-01-29 WO disclosed