SCHEMBL8539663

SCHEMBL8539663

CCCCn1c(=O)cc(Sc2ccccc2)n(Cc2ccc(-c3ccccc3-c3nnn[nH]3)cc2)c1=O

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 5/20 0.42
AGTR2 P50052 5/20 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
SCHEMBL8543557 0.89 AGTR1 (0.42) AGTR1AGTR2
SCHEMBL8539677 0.86 AGTR1 (0.49) AGTR1AGTR2
SCHEMBL8545829 0.85 AGTR1 (0.42) AGTR1AGTR2
SCHEMBL8544293 0.85 AGTR1 (0.43) AGTR1AGTR2
SCHEMBL8544429 0.85 AGTR1 (0.42) AGTR1AGTR2
SCHEMBL8539496 0.84 AGTR1 (0.40) AGTR1AGTR2
SCHEMBL8539660 0.84 AGTR1 (0.39) AGTR1AGTR2
SCHEMBL8538976 0.83 AGTR1 (0.40) AGTR1AGTR2
SCHEMBL8539208 0.81 AGTR1 (0.45) AGTR1AGTR2
SCHEMBL8544733 0.81 AGTR1 (0.38) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0442473-B1 Pyrimidinedione derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1998-08-19 EP disclosed
US-5162326-A Antagonists for angeotensin; hypotensive agents; treatment for heart diseases, strokes TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-11-10 US disclosed
EP-0442473-A1 Pyrimidinedione derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1991-08-21 EP disclosed