SCHEMBL9694889

SCHEMBL9694889

CCCCc1nc(C)c(C(=O)NCC(=O)OCC)n1Cc1ccc2oc(-c3ccccc3-c3nnn(C(c4ccccc4)(c4ccccc4)c4ccccc4)n3)c(Br)c2c1

nearest known ligand 0.54

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 1/20 0.54

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
SCHEMBL9694786 0.95 AGTR1 (0.60) AGTR1
SCHEMBL9695376 0.94 AGTR1 (0.46) AGTR1
SCHEMBL9693668 0.92 AGTR1 (0.48) AGTR1
SCHEMBL9310796 0.90 AGTR1 (0.56) AGTR1
SCHEMBL9694909 0.90 AGTR1 (0.64) AGTR1
SCHEMBL9308297 0.88 AGTR1 (0.57) AGTR1
SCHEMBL9859950 0.88 AGTR1 (0.61) AGTR1
SCHEMBL9695299 0.88 AGTR1 (0.55) AGTR1
SCHEMBL9309925 0.88 AGTR1 (0.58) AGTR1
SCHEMBL9310870 0.88 AGTR1 (0.65) AGTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0505954-A1 N-Imidazolylmethyl benzofuran derivatives as inhibitors of angiotensin II activity GLAXO GROUP LIMITED (GB) 1992-09-30 EP disclosed