SCHEMBL9402091

SCHEMBL9402091

CCCCc1nc2cccc(C(=O)OC)c2c(=O)n1Cc1ccc(-c2ccccc2-c2nnnn2COC)cc1

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 1/20 0.49
AGTR2 P50052 1/20 0.49

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
SCHEMBL9402062 0.88 AGT (0.46)
SCHEMBL9402009 0.84
SCHEMBL9402018 0.82 AGT (0.55)
SCHEMBL9402087 0.81 AGT (0.55) AGTR1AGTR2
SCHEMBL9197191 0.80 AGTR1 (0.53) AGTR1AGTR2
SCHEMBL9402082 0.80 AGT (0.54) AGTR1AGTR2
SCHEMBL9401991 0.79 AGT (0.54) AGTR1AGTR2
SCHEMBL9402079 0.79 AGT (0.53) AGTR1AGTR2
SCHEMBL9402048 0.79 AGT (0.53) AGTR1AGTR2
SCHEMBL9402052 0.78 AGT (0.53) 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-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