SCHEMBL7008517

SCHEMBL7008517

CCCc1cc2cccc(C(=O)OCOC(=O)C(C)(C)C)c2n1Cc1ccc(-c2ccccc2-c2nnnn2C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 2/20 0.49
AGTR2 P50052 2/20 0.49
AGT P01019 2/20 0.46
PPARG P37231 3/20 0.44

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
SCHEMBL7012281 0.93 AGTR1 (0.53) AGTR1AGTR2AGTPPARG
SCHEMBL7012426 0.87 AGT (0.49) AGTR1AGTR2AGTPPARG
SCHEMBL8112903 0.84 AGTR2 (0.52) AGTR1AGTR2AGTPPARG
SCHEMBL7010363 0.84 PPARG (0.44) AGTR1AGTR2PPARG
SCHEMBL7908421 0.81 AGTR1 (0.57) AGTR1AGTR2AGT
SCHEMBL7018967 0.81 AGTR1 (0.53) AGTR1AGTR2AGT
SCHEMBL8860958 0.80 AGTR1 (0.56) AGTR1AGTR2AGT
SCHEMBL7297174 0.80 AGTR1 (0.56) AGTR1AGTR2AGT
SCHEMBL7014089 0.80 AGTR1 (0.49) AGTR1AGTR2AGT
SCHEMBL7012415 0.80 AGT (0.43) AGTR1AGTR2AGT

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