SCHEMBL9318368

SCHEMBL9318368

CCc1nc2c(C)cc(CO)nc2n1Cc1ccc2oc(-c3ccccc3-c3nnn(C(c4ccccc4)(c4ccccc4)c4ccccc4)n3)c(Br)c2c1

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 2/20 0.42
AGTR2 P50052 1/20 0.42

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
SCHEMBL9318686 0.92 AGTR1 (0.48) AGTR1AGTR2
SCHEMBL9319165 0.91 AGTR1 (0.41) AGTR1AGTR2
SCHEMBL9318128 0.89 AGTR1 (0.42) AGTR1AGTR2
SCHEMBL9320253 0.84 AGTR1 (0.44) AGTR1
SCHEMBL9312340 0.84 AGTR1 (0.54) AGTR1
SCHEMBL9318071 0.82 AGTR1 (0.46) AGTR1
SCHEMBL9310080 0.82 AGTR1 (0.44) AGTR1
SCHEMBL9318727 0.82
SCHEMBL9859391 0.81 AGTR1 (0.48) AGTR1
SCHEMBL9309381 0.81 AGTR1 (0.64) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5317023-A 2-Phenyl-(imidazo(4,5-b)pyridyl-methyl-) derivatives; hypertensive agents; cognition activators GLAXO GROUP LIMITED (GB) 1994-05-31 US disclosed
WO-1992020679-A1 BENZOFURAN DERIVATIVES GLAXO GROUP LIMITED (GB) 1992-11-26 WO disclosed
EP-0514197-A1 Anti-hypertensive benzofuran derivatives substituted by N-imidazolyl-methyl groups which are condensed with optionally nitrogen containing, six-membered rings GLAXO GROUP LIMITED (GB) 1992-11-19 EP disclosed