SCHEMBL7015090

SCHEMBL7015090

CCCCc1nc2cccc(C(=O)OCOC(=O)C(C)(C)C)c2n1Cc1ccc2nc(-c3ccccc3-c3nnn[nH]3)ncc2c1

nearest known ligand 0.52

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 1/20 0.41
AGTR2 P50052 1/20 0.41

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
SCHEMBL7007160 0.90
SCHEMBL5503035 0.88 AGTR1 (0.49) AGTR1AGTR2
SCHEMBL7010230 0.88 AGTR1 (0.49) AGTR1AGTR2
SCHEMBL7005696 0.85 AGT (0.47) AGTR1AGTR2
SCHEMBL9192379 0.83 PPARG (0.46)
SCHEMBL9197447 0.81
SCHEMBL9194925 0.78 AGTR1 (0.59) AGTR1AGTR2
SCHEMBL7013727 0.78 AGTR1 (0.46) AGTR1AGTR2
SCHEMBL9198023 0.78 AGTR1 (0.53) AGTR1AGTR2
SCHEMBL166867 0.77 AGTR2 (0.56) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1327631-A2 Fused heterocyclic compounds, their production and use as angiotensin II antagonists Takeda Chemical Industries, Ltd. (JP) 2003-07-16 EP claimed
EP-0518033-A1 Fused heterocyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-12-16 EP claimed
EP-1327631-A2 Fused heterocyclic compounds, their production and use as angiotensin II antagonists Takeda Chemical Industries, Ltd. (JP) 2003-07-16 EP disclosed
EP-0518033-B1 Fused heterocyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-07-02 EP disclosed
US-5389641-A Fused heterocyclic compounds, having angiotensin II antagonistic activity TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1995-02-14 US disclosed
EP-0518033-A1 Fused heterocyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-12-16 EP disclosed