SCHEMBL6946095

SCHEMBL6946095

Cc1cc(C)c2cccc(OCc3c(Cl)ccc(S(=O)(=O)OC(=O)[C@@H]4CCCN4)c3Cl)c2n1

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 8/20 0.53
RORC P51449 12/20 0.52

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
SCHEMBL8181783 0.93 BDKRB2 (0.47) BDKRB2RORC
SCHEMBL6942965 0.88 BDKRB2 (0.54) BDKRB2RORC
SCHEMBL6944540 0.87 RORC (0.66) BDKRB2RORC
SCHEMBL6945241 0.87 RORC (0.66) BDKRB2RORC
SCHEMBL6938693 0.87 RORC (0.51) BDKRB2RORC
SCHEMBL8189408 0.86 BDKRB2 (0.40) BDKRB2RORC
SCHEMBL4065387 0.79 BDKRB2 (0.63) BDKRB2RORC
SCHEMBL7952802 0.77 RORC (0.72) BDKRB2RORC
SCHEMBL6946090 0.77 RORC (0.83) BDKRB2RORC
SCHEMBL3743960 0.77 RORC (0.83) 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-0944618-B1 NOVEL N-BENZENESULPHONYL-L-PROLINE DERIVATIVES, METHOD FOR PREPARING AND THERAPEUTIC USE FOURNIER IND & SANTE (FR) 2003-09-24 EP disclosed
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
US-6063791-A N-benzenesulfonyl-L-proline derivatives, method for preparing and therapeutic use FOURNIER INDUSTRIE ET SANTE (FR) 2000-05-16 US disclosed