SCHEMBL9664203

SCHEMBL9664203

CCc1nc(C2CC2)c(C(=O)O)n1Cc1ccc2oc(-c3ccccc3[N+](=O)[O-])c(Br)c2c1

nearest known ligand 0.69

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 1/20 0.48

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
SCHEMBL9664193 1.00 AGTR1 (0.48) AGTR1
SCHEMBL9664100 0.89
SCHEMBL9664084 0.89
SCHEMBL8547857 0.89
SCHEMBL7312302 0.88 AGTR1 (0.51) AGTR1
SCHEMBL9662751 0.88
SCHEMBL9663216 0.88 AGTR1 (0.50) AGTR1
SCHEMBL7308624 0.83 AGTR1 (0.46) AGTR1
SCHEMBL8547890 0.83 AGTR1 (0.53) AGTR1
SCHEMBL8957327 0.81

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-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