SCHEMBL8548745

SCHEMBL8548745

Cc1nc(C2CC2)n(Cc2c3ccocc-3c(Br)c2-c2ccccc2-c2nnn[nH]2)c1C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 2/20 0.37
AGTR2 P50052 2/20 0.37

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
SCHEMBL8545470 0.91 AGTR1 (0.35) AGTR1AGTR2
SCHEMBL9309541 0.90
SCHEMBL8550462 0.88
SCHEMBL9859908 0.87 AGTR1 (0.32) AGTR1AGTR2
Hydrochloric Acid SCHEMBL9309853 0.86 AGTR1 (0.31) AGTR1AGTR2
SCHEMBL8548762 0.86 ABCB11 (0.30) AGTR1AGTR2
SCHEMBL9309539 0.86 AGTR1 (0.36) AGTR1AGTR2
SCHEMBL8547883 0.85 PPARG (0.32) AGTR1AGTR2
SCHEMBL9311445 0.85 AGTR1 (0.33) AGTR1AGTR2
SCHEMBL9309706 0.84 AGTR1 (0.40) AGTR1AGTR2

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0514198-B1 1H-Imidazol-1-yl-methyl benzofuran derivatives with the imidazolyl moiety being substituted by a cycloalkyl group GLAXO GROUP LTD (GB) 1998-08-05 EP claimed
EP-0514198-A1 1H-Imidazol-1-yl-methyl benzofuran derivatives with the imidazolyl moiety being substituted by a cycloalkyl group GLAXO GROUP LIMITED (GB) 1992-11-19 EP claimed
JP-6211846-A None JP disclosed
EP-0514198-B1 1H-Imidazol-1-yl-methyl benzofuran derivatives with the imidazolyl moiety being substituted by a cycloalkyl group GLAXO GROUP LTD (GB) 1998-08-05 EP disclosed
US-5498722-A HYPOTENSIVES GLAXO GROUP (GB) 1996-03-12 US disclosed
JP-H06211846-A BENZOFURAN DERIVATIVE GLAXO GROUP LTD 1994-08-02 JP disclosed
US-5332831-A Angiotensin antagonist GLAXO GROUP LIMITED (GB) 1994-07-26 US disclosed
WO-1992020674-A1 1H-IMIDAZOL-1-YL-METHYL BENZOFURAN DERIVATIVES, WITH THE IMIDAZOLYL MOIETY BEING SUBSTITUTED BY A CYCLOALKYL GROUP GLAXO GROUP LIMITED (GB) 1992-11-26 WO disclosed
EP-0514198-A1 1H-Imidazol-1-yl-methyl benzofuran derivatives with the imidazolyl moiety being substituted by a cycloalkyl group GLAXO GROUP LIMITED (GB) 1992-11-19 EP disclosed