SCHEMBL7015844

SCHEMBL7015844

CNC(=O)c1ccc(/C=C/C(=O)C(N)c2sccc2-c2ccc(C)c(CCl)c2C)cc1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 16/20 0.46
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32

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
SCHEMBL7016095 0.92 BDKRB2 (0.46) BDKRB2KDM4EALDH1A1HPGD
SCHEMBL7015850 0.81 BDKRB2 (0.65) BDKRB2ALDH1A1HPGD
SCHEMBL7015847 0.81 BDKRB2 (0.65) BDKRB2ALDH1A1HPGD
SCHEMBL7012812 0.80 BDKRB2 (0.75) BDKRB2
SCHEMBL8014941 0.75 BDKRB2 (0.57) BDKRB2
SCHEMBL7016100 0.73 BDKRB2 (0.66) BDKRB2KDM4EALDH1A1HPGD
SCHEMBL7016097 0.73 BDKRB2 (0.66) BDKRB2KDM4EALDH1A1HPGD
SCHEMBL7012170 0.69 NPC1 (0.47) BDKRB2KDM4EALDH1A1HPGD
SCHEMBL7012168 0.69 NPC1 (0.47) BDKRB2KDM4EALDH1A1HPGD
SCHEMBL6646399 0.67 BDKRB2 (0.64) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0861243-B1 HETEROCYCLIC COMPOUNDS AS BRADYKININ ANTAGONISTS FUJISAWA PHARMACEUTICAL CO (JP) 2003-11-12 EP disclosed
US-6344462-B1 Heterocyclic compounds as bradykinin antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-02-05 US disclosed
US-6127389-A TREATMENT OF HYPERTENSION, RENAL DISEASES, HEART FAILURE, HYPERTENSION, MENIERE'S DISEASE, PERIPHERAL AND CEREBRAL CIRCULATORY DISORDERS, CLIMACTERIC DISTURBANCE, RETINOCHOROIDAL CIRCULATORY DISORDERS, MYOCARDIAL ISCHEMIA FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-10-03 US disclosed
US-6100284-A ANTIALLERGENS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-08-08 US disclosed
US-6015818-A TREATING KIDNEY, BRAIN, AND CARDIOVASCULAR DISORDERS; HYPOTENSIVE AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-01-18 US disclosed
US-6008229-A TREATING ALLERGY, INFLAMMATION, AUTOIMMUNE DISEASE, SHOCK, PAIN FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-12-28 US disclosed