SCHEMBL6578892

SCHEMBL6578892

Cc1ccc2cccc(OCc3c(Cl)ccc(N(C)C(=O)CN)c3C#N)c2n1

nearest known ligand 0.75

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 14/20 0.57

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
SCHEMBL6580648 0.90 BDKRB2 (0.50) BDKRB2
SCHEMBL5663232 0.88 BDKRB2 (0.67) BDKRB2
SCHEMBL17475440 0.86 BDKRB2 (0.50) BDKRB2
SCHEMBL17475443 0.86 BDKRB2 (0.61) BDKRB2
SCHEMBL6581342 0.86 BDKRB2 (0.56) BDKRB2
SCHEMBL17475441 0.85 BDKRB2 (0.57) BDKRB2
SCHEMBL17475445 0.84 BDKRB2 (0.51) BDKRB2
SCHEMBL17475447 0.82 BDKRB2 (0.59) BDKRB2
SCHEMBL8361810 0.82 BDKRB2 (0.66) BDKRB2
SCHEMBL6580497 0.81 BDKRB2 (0.57) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0867432-B1 Fused N-heterocyclic compounds substituted with benzyloxy, process for their preparation and their use as bradykinin receptor antagonists AVENTIS PHARMA GMBH (DE) 2004-06-09 EP disclosed
US-6211196-B1 8-BENZYLOXY-(TETRAHYDRO)QUINOLINE DERIVATIVES; LIVER CIRRHOSIS, ALZHEIMER*S DISEASE AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2001-04-03 US disclosed
EP-0867432-A2 Fused N-heterocyclic compounds substituted with benzyloxy, process for their preparation and their use as bradykinin receptor antagonists HOECHST AKTIENGESELLSCHAFT (DE) 1998-09-30 EP disclosed