SCHEMBL8554602

SCHEMBL8554602

CC(=O)Nc1[nH]cc(C)c1-c1ccc(Cl)c(COc2cccc3c(OCc4ccccn4)cc(C)nc23)c1Cl

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 17/20 0.55
RORC P51449 3/20 0.44

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
SCHEMBL8724045 0.83 BDKRB2 (0.57) BDKRB2RORC
SCHEMBL8724025 0.82 BDKRB2 (0.58) BDKRB2RORC
SCHEMBL8018457 0.80 BDKRB2 (0.55) BDKRB2RORC
SCHEMBL6969976 0.77 BDKRB2 (0.77) BDKRB2
SCHEMBL8719597 0.76 BDKRB2 (0.55) BDKRB2RORC
SCHEMBL8018453 0.75 BDKRB2 (0.61) BDKRB2
SCHEMBL8549625 0.75 BDKRB2 (0.71) BDKRB2
SCHEMBL8018900 0.75 BDKRB2 (0.47) BDKRB2
SCHEMBL8002771 0.75 BDKRB2 (0.45) BDKRB2
SCHEMBL658539 0.74 BDKRB2 (0.67) BDKRB2

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-0879233-A1 CHINOLINE AND BENZIMIDAZOLE DERIVATIVES AS BRADYKININ AGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-11-25 EP disclosed
WO-1997028153-A1 CHINOLINE AND BENZIMIDAZOLE DERIVATIVES AS BRADYKININ AGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-08-07 WO disclosed