SCHEMBL7828954

SCHEMBL7828954

Cc1ccc2cccc(OCc3c(Cl)ccc(N(C)C(=O)CNC(=O)NCc4ccncc4)c3Cl)c2n1

nearest known ligand 0.69

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 19/20 0.69

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
Hydrochloric Acid SCHEMBL7743052 0.99 BDKRB2 (0.69) BDKRB2
SCHEMBL7742427 0.94 BDKRB2 (0.75) BDKRB2
Hydrochloric Acid SCHEMBL7749663 0.93 BDKRB2 (0.76) BDKRB2
SCHEMBL8361694 0.92 BDKRB2 (0.79) BDKRB2
SCHEMBL7839657 0.92 BDKRB2 (0.75) BDKRB2
Hydrochloric Acid SCHEMBL7742700 0.91 BDKRB2 (0.75) BDKRB2
SCHEMBL8364488 0.90 BDKRB2 (0.73) BDKRB2
SCHEMBL7746482 0.90 BDKRB2 (0.76) BDKRB2
Hydrochloric Acid SCHEMBL7747344 0.89 BDKRB2 (0.77) BDKRB2
SCHEMBL7748521 0.89 BDKRB2 (0.73) 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-0622361-B1 Heterocyclic compounds as bradykinin antagonists FUJISAWA PHARMACEUTICAL CO (JP) 2001-10-04 EP disclosed
US-5563162-A CAN BE ADMINISTERD FOR THE TREATMENT OF ALLERGY, INFLAMMATION, AUTOIMMUNE DISEASES, SHOCK OR PAIN IN ANIMALS AND HUMANS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-10-08 US disclosed
EP-0622361-A1 Heterocyclic compounds as bradykinin antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-11-02 EP disclosed