SCHEMBL7749822

SCHEMBL7749822

CCOCCNC(=O)c1ccc(/C=C/C(=O)NCC(=O)N(C)c2ccc(Cl)c(COc3cccc4ccc(C)nc34)c2Cl)cc1

nearest known ligand 0.83

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 20/20 0.83

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
SCHEMBL7749829 1.00 BDKRB2 (0.83) BDKRB2
SCHEMBL7742642 0.95 BDKRB2 (0.85) BDKRB2
SCHEMBL7742639 0.95 BDKRB2 (0.85) BDKRB2
Hydrochloric Acid SCHEMBL7742354 0.94 BDKRB2 (0.85) BDKRB2
Hydrochloric Acid SCHEMBL7742352 0.94 BDKRB2 (0.85) BDKRB2
SCHEMBL7742705 0.94 BDKRB2 (0.86) BDKRB2
SCHEMBL7742702 0.94 BDKRB2 (0.86) BDKRB2
SCHEMBL7742740 0.93 BDKRB2 (0.83) BDKRB2
SCHEMBL7742733 0.93 BDKRB2 (0.83) BDKRB2
SCHEMBL7746894 0.93 BDKRB2 (0.86) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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