SCHEMBL8944479

SCHEMBL8944479

CCCCc1nc2ccc(NC(=O)NC3CCCCC3)cc2n1Cc1ccc(-c2ccccc2C(=O)NS(=O)(=O)c2ccccc2)cc1

nearest known ligand 0.83

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 2/20 0.83
AGTR1 P30556 1/20 0.83

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
SCHEMBL8393396 0.93 AGTR1 (0.84) AGTR2AGTR1
SCHEMBL6567316 0.91 AGTR1 (1.00) AGTR2AGTR1
SCHEMBL9040646 0.91 AGTR2 (0.73) AGTR2AGTR1
SCHEMBL8393599 0.90 AGTR1 (0.80) AGTR2AGTR1
SCHEMBL8944346 0.90 AGTR2 (0.67) AGTR2AGTR1
SCHEMBL8391388 0.90 AGTR2 (0.68) AGTR2AGTR1
Trifluoroacetic Acid SCHEMBL8391416 0.87 AGTR1 (0.92) AGTR2AGTR1
SCHEMBL8396359 0.87 AGTR2 (0.68) AGTR2AGTR1
SCHEMBL8393366 0.86 AGTR1 (0.82) AGTR2AGTR1
SCHEMBL8396463 0.86 AGTR2 (0.67) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5541229-A ANGIOITENSIN II ANTAGONIST AS HYPOTENSIVE AGENTS, ANTIISCHEMIC AGENTS AND CARDIOVASCULAR DISORDERS DR. KARL THOMAE GMBH (DE) 1996-07-30 US disclosed