SCHEMBL9309746

SCHEMBL9309746

CCCCc1nc(I)c(C(=O)O)n1Cc1c2ccocc-2c(Br)c1-c1ccccc1-c1nnn(C(c2ccccc2)(c2ccccc2)c2ccccc2)n1

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 8/20 0.38
AGTR2 P50052 7/20 0.35

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
SCHEMBL9308308 0.94 AGTR1 (0.38) AGTR1AGTR2
SCHEMBL9859673 0.93 AGTR1 (0.39) AGTR1AGTR2
SCHEMBL9694922 0.93 AGTR1 (0.39) AGTR1AGTR2
SCHEMBL9309861 0.92 AGTR1 (0.46) AGTR1AGTR2
SCHEMBL9859639 0.91 AGTR1 (0.37) AGTR1AGTR2
SCHEMBL9859961 0.91 AGTR1 (0.38) AGTR1AGTR2
SCHEMBL9310038 0.90 AGTR1 (0.40) AGTR1AGTR2
SCHEMBL9860046 0.90 AGTR1 (0.35) AGTR1AGTR2
SCHEMBL9309799 0.89 AGTR1 (0.41) AGTR1AGTR2
SCHEMBL9309931 0.88 AGTR1 (0.39) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5374646-A Treatment or prophylasix of hypertension and diseases associated with cognitive disorders GLAXO GROUP LIMITED (GB) 1994-12-20 US disclosed
EP-0434249-A2 Benzofuran derivatives GLAXO GROUP LIMITED (GB) 1991-06-26 EP disclosed