SCHEMBL8801976

SCHEMBL8801976

CCc1ccc2cccc(OCc3c(Cl)ccc(N(C)C(=O)CNC(=O)Nc4ccc(C(=O)Nc5ccncc5)cc4)c3Cl)c2n1

nearest known ligand 0.70

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 20/20 0.70

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
SCHEMBL8367321 0.92 BDKRB2 (0.83) BDKRB2
SCHEMBL7746482 0.86 BDKRB2 (0.76) BDKRB2
SCHEMBL7747764 0.86 BDKRB2 (0.65) BDKRB2
SCHEMBL7747429 0.86 BDKRB2 (0.82) BDKRB2
Hydrochloric Acid SCHEMBL7747344 0.86 BDKRB2 (0.77) BDKRB2
SCHEMBL7747123 0.85 BDKRB2 (0.75) BDKRB2
Hydrochloric Acid SCHEMBL7749643 0.85 BDKRB2 (0.66) BDKRB2
Hydrochloric Acid SCHEMBL7747791 0.85 BDKRB2 (0.82) BDKRB2
SCHEMBL8364488 0.85 BDKRB2 (0.73) BDKRB2
SCHEMBL7749912 0.83 BDKRB2 (0.70) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0807105-A1 PYRIDOPYRIMIDONES, QUINOLINES AND FUSED N-HERETOCYCLES AS BRADYKININ ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-11-19 EP disclosed