SCHEMBL12712383

SCHEMBL12712383

C/C=C\Nc1cc(C)nc2c(OCc3c(Cl)cncc3CNC(=O)C(CC)CC)cccc12

nearest known ligand 0.58

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 20/20 0.58

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
SCHEMBL12711892 0.93 BDKRB2 (0.59) BDKRB2
SCHEMBL12711915 0.89 BDKRB2 (0.55) BDKRB2
SCHEMBL12711933 0.89 BDKRB2 (0.49) BDKRB2
SCHEMBL12711896 0.88 BDKRB2 (0.56) BDKRB2
SCHEMBL12711480 0.87 BDKRB2 (0.54) BDKRB2
SCHEMBL12711479 0.86 BDKRB2 (0.54) BDKRB2
SCHEMBL12711481 0.86 BDKRB2 (0.54) BDKRB2
SCHEMBL12711393 0.85 BDKRB2 (0.56) BDKRB2
SCHEMBL12711841 0.85 BDKRB2 (0.53) BDKRB2
SCHEMBL12711797 0.85 BDKRB2 (0.49) 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-2305668-A1 8-oxy-quinoline derivatives as bradykinin B2 receptor modulators Jerini AG (DE) 2011-04-06 EP disclosed