SCHEMBL7742442

SCHEMBL7742442

Cc1ccc2cccc(OCc3c(Cl)ccc(N(C)C(=O)CNC(=O)Nc4cccc(C(=O)N(C)Cc5ccccn5)c4)c3Cl)c2n1

nearest known ligand 0.62

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 20/20 0.62

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 SCHEMBL7748032 0.99 BDKRB2 (0.62) BDKRB2
SCHEMBL7742859 0.90 BDKRB2 (0.65) BDKRB2
SCHEMBL7742862 0.90 BDKRB2 (0.64) BDKRB2
SCHEMBL7749616 0.90 BDKRB2 (0.67) BDKRB2
Hydrochloric Acid SCHEMBL7748625 0.90 BDKRB2 (0.65) BDKRB2
Hydrochloric Acid SCHEMBL7748518 0.90 BDKRB2 (0.64) BDKRB2
Hydrochloric Acid SCHEMBL7749568 0.90 BDKRB2 (0.67) BDKRB2
SCHEMBL7748055 0.89 BDKRB2 (0.76) BDKRB2
SCHEMBL7837989 0.89 BDKRB2 (0.66) BDKRB2
SCHEMBL7750187 0.89 BDKRB2 (0.66) 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 4 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-6169095-B1 FOR PREVENTION AND/OR TREATMENT OF BRADYKININ OR ITS ANALOGUES MEDIATED DISEASES IN THE EYE, SUCH AS ALLERGY, INFLAMMATION AND PAIN OF THE EYE FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-01-02 US 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