SCHEMBL7008968

SCHEMBL7008968

CCCCc1nc2cccc(C(=O)OC)c2n1Cc1ccc(-c2ccccc2C#N)nc1

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 4/20 0.46
AGTR1 P30556 3/20 0.46

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
SCHEMBL7015958 0.91 AGTR2 (0.51) AGTR2AGTR1
SCHEMBL7016557 0.89 PPARG (0.58) AGTR2AGTR1
SCHEMBL9194503 0.86 PPARG (0.57)
SCHEMBL7014285 0.84 TLR7 (0.45) AGTR2AGTR1
SCHEMBL7017108 0.83 PPARG (0.65)
SCHEMBL7013727 0.83 AGTR1 (0.46) AGTR2AGTR1
SCHEMBL7007312 0.81 AGTR2 (0.63) AGTR2AGTR1
SCHEMBL9199820 0.81 PPARG (0.57) AGTR2AGTR1
SCHEMBL7016826 0.81 TLR7 (0.49)
SCHEMBL7013710 0.81 AGTR1 (0.44) AGTR2AGTR1

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 4 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 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