SCHEMBL6578830

SCHEMBL6578830

COc1ccc(N)c(Cl)c1COc1cccc2ccc(C)nc12

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 8/20 0.60
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
KDM4E B2RXH2 3/20 0.45
ALDH1A1 P00352 2/20 0.45
PTGDR2 Q9Y5Y4 1/20 0.45
MCHR1 Q99705 1/20 0.44
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
POLB P06746 1/20 0.42

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
SCHEMBL6936587 0.88 BDKRB2 (0.66) BDKRB2MEN1KMT2A
Hydrochloric Acid SCHEMBL6644122 0.87 BDKRB2 (0.65) BDKRB2MEN1KMT2A
SCHEMBL6580622 0.87 BDKRB2 (0.55) BDKRB2MEN1KMT2AKDM4EALDH1A1
SCHEMBL6580766 0.86 BDKRB2 (0.54) BDKRB2MEN1KMT2AKDM4EALDH1A1
SCHEMBL6578383 0.83 BDKRB2 (0.51) BDKRB2MEN1KMT2AKDM4EALDH1A1
SCHEMBL6578777 0.83 BDKRB2 (0.62) BDKRB2MEN1KMT2APTGDR2
SCHEMBL6581519 0.82 MCHR1 (0.50) BDKRB2MEN1KMT2AKDM4EALDH1A1
SCHEMBL6580680 0.81 MEN1 (0.58) BDKRB2MEN1KMT2AKDM4EALDH1A1
SCHEMBL6580497 0.79 BDKRB2 (0.57) BDKRB2
SCHEMBL7746973 0.79 BDKRB2 (0.82) BDKRB2MEN1KMT2AKDM4EPTGDR2

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