SCHEMBL7007240

SCHEMBL7007240

CCCCc1nc2c(C)cnc(C(=O)OC)c2n1Cc1ccc(-c2ccccc2-c2nnnn2C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AGT P01019 2/20 0.53
AGTR1 P30556 2/20 0.53
AGTR2 P50052 2/20 0.53
TLR7 Q9NYK1 1/20 0.45

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
SCHEMBL7018988 0.96 AGTR1 (0.58) AGTAGTR1AGTR2
SCHEMBL7306366 0.88 AGTR1 (0.57) AGTAGTR1AGTR2
SCHEMBL809 0.84 AGT (0.57) AGTAGTR1AGTR2
SCHEMBL7299314 0.84 AGTR1 (0.56) AGTAGTR1AGTR2
SCHEMBL9030414 0.83 AGTR1 (0.63) AGTAGTR1AGTR2
SCHEMBL7015976 0.82 AGTR1 (0.50) AGTR1AGTR2
SCHEMBL14855254 0.82 AGTR1 (0.61) AGTAGTR1AGTR2
SCHEMBL9385090 0.81 AGT (0.61) AGTAGTR1AGTR2
SCHEMBL7310565 0.81 AGTR1 (0.59) AGTAGTR1AGTR2
SCHEMBL14855371 0.81 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 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