SCHEMBL7015976

SCHEMBL7015976

CCCCc1nc2c(C)cnc(C(=O)OC)c2n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.65

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 2/20 0.50
AGTR2 P50052 2/20 0.50

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
SCHEMBL7010808 0.95 AGTR1 (0.49) AGTR1AGTR2
SCHEMBL7006585 0.93 AGTR2 (0.50) AGTR1AGTR2
SCHEMBL7011915 0.88 AGTR1 (0.45) AGTR1AGTR2
SCHEMBL7009704 0.88 PPARG (0.49) AGTR1AGTR2
SCHEMBL7011920 0.88 PPARG (0.49) AGTR1AGTR2
SCHEMBL7011909 0.88 PPARG (0.49) AGTR1AGTR2
SCHEMBL7304486 0.83 AGTR1 (0.57) AGTR1AGTR2
SCHEMBL9043618 0.83 AGTR1 (0.50) AGTR1AGTR2
SCHEMBL9196961 0.83
SCHEMBL9191519 0.83 AGTR1 (0.52) 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 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