SCHEMBL9859425

SCHEMBL9859425

O=Cc1nc(Cl)c(C(=O)O)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
SCHEMBL9309480 0.92 AGTR1 (0.49) AGTR1
SCHEMBL9859143 0.91 AGTR1 (0.55) AGTR1
SCHEMBL9859763 0.90 AGTR1 (0.55) AGTR1
SCHEMBL9308702 0.90 AGTR1 (0.57) AGTR1
SCHEMBL9309381 0.89 AGTR1 (0.64) AGTR1
SCHEMBL9309789 0.87 AGTR1 (0.68) AGTR1
SCHEMBL9309852 0.86 AGTR1 (0.74) AGTR1
SCHEMBL9860031 0.85 AGTR1 (0.56) AGTR1
SCHEMBL9308430 0.85 AGTR1 (0.48) AGTR1
SCHEMBL9310941 0.84 AGTR1 (0.51) 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-0434249-A2 Benzofuran derivatives GLAXO GROUP LIMITED (GB) 1991-06-26 EP disclosed