SCHEMBL9197191

SCHEMBL9197191

CCCCc1nc2cccc(C(=O)OC)c2n1Cc1ccc(-c2ccccc2-c2nnnn2C)cc1

nearest known ligand 0.83

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 2/20 0.53
AGTR2 P50052 2/20 0.53

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
SCHEMBL9192195 0.91 AGTR2 (0.62) AGTR1AGTR2
SCHEMBL9197625 0.86
SCHEMBL7014033 0.86 AGTR2 (0.72) AGTR1AGTR2
SCHEMBL7011288 0.85 AGTR2 (0.58) AGTR1AGTR2
SCHEMBL7017061 0.85 AGTR2 (0.58) AGTR1AGTR2
SCHEMBL9196961 0.85
SCHEMBL9085616 0.83 AGTR2 (0.56) AGTR1AGTR2
SCHEMBL12829245 0.83 AGTR2 (0.60) AGTR1AGTR2
SCHEMBL7145725 0.83 AGTR2 (0.57) AGTR1AGTR2
SCHEMBL7016557 0.83 PPARG (0.58) 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-0425921-B1 Benzimidazole derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1995-08-09 EP disclosed
US-5250554-A Cardiovascular disorders TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-10-05 US disclosed
US-5128356-A Angiotensin antagonist; cardiovascular disorders TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-07-07 US disclosed
EP-0425921-A1 Benzimidazole derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1991-05-08 EP disclosed