SCHEMBL7812410

SCHEMBL7812410

Cc1ccc2cccc(OCc3c(Cl)ccc(S(=O)(=O)N4CCC[C@H]4C(=O)NCCCNC(=O)OC(C)(C)C)c3Cl)c2n1

nearest known ligand 0.63

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 9/20 0.63
RORC P51449 11/20 0.60
BDKRB1 P46663 1/20 0.56

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
SCHEMBL7814772 1.00 BDKRB2 (0.63) BDKRB2RORCBDKRB1
SCHEMBL7814889 0.99 BDKRB2 (0.61) BDKRB2RORCBDKRB1
SCHEMBL7811148 0.93 BDKRB2 (0.58) BDKRB2RORCBDKRB1
SCHEMBL7945796 0.91 BDKRB2 (0.57) BDKRB2RORCBDKRB1
SCHEMBL7815579 0.91 BDKRB2 (0.65) BDKRB2RORCBDKRB1
SCHEMBL7814556 0.91 BDKRB2 (0.57) BDKRB2RORCBDKRB1
SCHEMBL7811061 0.90 BDKRB2 (0.66) BDKRB2RORCBDKRB1
SCHEMBL7818251 0.90 BDKRB2 (0.66) BDKRB2RORCBDKRB1
SCHEMBL7959602 0.90 BDKRB2 (0.77) BDKRB2RORC
SCHEMBL7818085 0.90 BDKRB2 (0.71) BDKRB2RORCBDKRB1

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-0874841-B1 1-BENZENESULFONYL PYRROLIDINE DERIVATIVES AS BRADYKININ RECEPTOR ANTAGONISTS FOURNIER IND & SANTE (FR) 2001-10-04 EP disclosed
US-6211181-B1 ANTIINFLAMMATORY AGENTS, ANALGESICS, ANTIALLERGENS, AND ANTIASTHMATICS FOURNIER INDUSTRIE ET SANTE (FR) 2001-04-03 US disclosed