SCHEMBL9694829

SCHEMBL9694829

CCCc1nc(Cl)c(C(=O)NCCC(=O)OCC)n1Cc1c2ccocc-2c(Br)c1-c1ccccc1-c1nnn[nH]1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
AGTR1 P30556 5/20 0.33
AGTR2 P50052 3/20 0.33
EDNRA P25101 3/20 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
SCHEMBL9694718 0.94 AGTR1 (0.34) AGTR1AGTR2EDNRA
SCHEMBL9693538 0.93 AGTR1 (0.34) AGTR1AGTR2EDNRA
SCHEMBL9694827 0.91 AGTR1 (0.37) AGTR1AGTR2
SCHEMBL9694855 0.90 AGTR1 (0.35) AGTR1AGTR2EDNRA
SCHEMBL9310369 0.90 AGTR1 (0.40) AGTR1AGTR2EDNRA
SCHEMBL9694921 0.89 HPGD (0.31) MAPTALDH1A1GAA
SCHEMBL9309814 0.89 AGTR1 (0.35) AGTR1AGTR2EDNRA
SCHEMBL9309579 0.88 AGTR1 (0.39) AGTR1AGTR2
SCHEMBL9694927 0.87 AGTR1 (0.37) AGTR1AGTR2
SCHEMBL9309262 0.87 AGTR1 (0.42) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1992016552-A1 1-IMIDAZOLGEMETHYL BENZOFURAN DERIVATIVES AS INHIBITORS OF ANGIOTENSIN II ACTIVITY GLAXO GROUP LIMITED (GB) 1992-10-01 WO claimed
EP-0505954-A1 N-Imidazolylmethyl benzofuran derivatives as inhibitors of angiotensin II activity GLAXO GROUP LIMITED (GB) 1992-09-30 EP claimed
WO-1992016552-A1 1-IMIDAZOLGEMETHYL BENZOFURAN DERIVATIVES AS INHIBITORS OF ANGIOTENSIN II ACTIVITY GLAXO GROUP LIMITED (GB) 1992-10-01 WO disclosed
EP-0505954-A1 N-Imidazolylmethyl benzofuran derivatives as inhibitors of angiotensin II activity GLAXO GROUP LIMITED (GB) 1992-09-30 EP disclosed