SCHEMBL9401993

SCHEMBL9401993

CCCCc1ncc(C(=O)OCC)c(=O)n1Cc1ccc(-c2ccccc2-c2nnnn2C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGT P01019 2/20 0.61
AGTR1 P30556 3/20 0.53
AGTR2 P50052 2/20 0.53

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
SCHEMBL9026501 0.85 AGTR1 (0.54) AGTAGTR1AGTR2
SCHEMBL1970464 0.85 AGTR1 (0.56) AGTAGTR1AGTR2
SCHEMBL8886621 0.84 AGTR1 (0.56) AGTAGTR1AGTR2
SCHEMBL9402028 0.83 AGT (0.58) AGTAGTR1AGTR2
SCHEMBL8252592 0.83 AGTR1 (0.55) AGTAGTR1AGTR2
SCHEMBL9401999 0.83 AGTR1 (0.54) AGTAGTR1AGTR2
SCHEMBL9385090 0.83 AGT (0.61) AGTAGTR1AGTR2
SCHEMBL9563478 0.83 AGT (0.52) AGTAGTR1AGTR2
SCHEMBL14855371 0.82 AGT (0.60) AGTAGTR1AGTR2
SCHEMBL4688038 0.82 AGT (0.60) AGTAGTR1AGTR2

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-5304565-A Angiotensin II antagonists TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-04-19 US disclosed
EP-0445811-A2 Nitrogen-containing heterocyclic compounds, their production and use Takeda Chemical Industries, Ltd. (JP) 1991-09-11 EP disclosed