SCHEMBL8885259

SCHEMBL8885259

CCCc1c(CO)cc(CO)c(=O)n1Cc1ccc(-c2ccccc2-c2nnnn2C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 2/20 0.59
AGTR2 P50052 2/20 0.59
AGT P01019 2/20 0.48

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
SCHEMBL8885235 0.90 AGTR1 (0.54) AGTR1AGTR2AGT
SCHEMBL8886621 0.83 AGTR1 (0.56) AGTR1AGTR2AGT
SCHEMBL595068 0.80 AGTR1 (0.56) AGTR1AGTR2AGT
SCHEMBL9402017 0.80 AGTR1 (0.69) AGTR1AGTR2AGT
SCHEMBL2070872 0.80 AGTR2 (0.57) AGTR1AGTR2AGT
SCHEMBL9030074 0.79 AGTR1 (0.65) AGTR1AGTR2AGT
SCHEMBL8884915 0.79 AGTR1 (0.56) AGTR1AGTR2AGT
SCHEMBL7304474 0.79 AGTR1 (0.64) AGTR1AGTR2AGT
SCHEMBL9030137 0.79 AGTR2 (0.64) AGTR1AGTR2AGT
SCHEMBL14855527 0.78 AGTR1 (0.66) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5599823-A HYPOTENSIVE AGENTS BAYER AKTIENGESELLSCHAFT (DE) 1997-02-04 US disclosed
US-5356911-A Hypotensive agents BAYER AKTIENGESELLSCHAFT (DE) 1994-10-18 US disclosed
EP-0542059-A1 Substituted biphenylpyridinones as angiotensin II antagonists BAYER AG (DE) 1993-05-19 EP disclosed