SCHEMBL9859400

SCHEMBL9859400

CCCCc1nc(Cl)c(C(=O)O)n1Cc1c2ccocc-2c(Br)c1-c1ccccc1NC(=O)OC(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 3/20 0.43
AGTR1 P30556 3/20 0.41

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
SCHEMBL9310231 0.96 AGTR2 (0.42) AGTR2AGTR1
SCHEMBL9311293 0.93 AGTR2 (0.35) AGTR2AGTR1
SCHEMBL9308986 0.93 AGTR1 (0.37) AGTR2AGTR1
SCHEMBL9309256 0.88 AGTR1 (0.38) AGTR2AGTR1
SCHEMBL9311427 0.88 AGTR1 (0.39) AGTR2AGTR1
SCHEMBL9309917 0.85 AGTR1 (0.37) AGTR2AGTR1
SCHEMBL9309104 0.85 MKNK2 (0.34) AGTR2AGTR1
SCHEMBL9309117 0.85 AGTR1 (0.49) AGTR2AGTR1
SCHEMBL9677392 0.85 BRD4 (0.36) AGTR2AGTR1
SCHEMBL9310813 0.85 AGTR2 (0.45) AGTR2AGTR1

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