SCHEMBL8353166

SCHEMBL8353166

CCOC(=O)C(=O)c1c(SC)nc(C)n1Cc1ccc(-c2ccccc2S(N)(=O)=O)cc1

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 5/20 0.46
AGTR1 P30556 4/20 0.46

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
SCHEMBL8353547 0.85 AGTR2 (0.42) AGTR2AGTR1
SCHEMBL8348556 0.84 AGTR2 (0.67) AGTR2AGTR1
SCHEMBL8345736 0.83 AGTR2 (0.61) AGTR2
SCHEMBL7613378 0.81 AGTR1 (0.60) AGTR2AGTR1
SCHEMBL7608200 0.79 AGTR1 (0.63) AGTR2AGTR1
SCHEMBL7608189 0.78 AGTR1 (0.49) AGTR2AGTR1
SCHEMBL8353008 0.76 AGTR2 (0.53) AGTR2AGTR1
SCHEMBL8638034 0.76 AGTR2 (0.54) AGTR2AGTR1
SCHEMBL7617595 0.75 AGTR1 (0.76) AGTR2AGTR1
SCHEMBL8640736 0.75 AGTR2 (0.56) 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-5977155-A CARDIOVASCULAR, KIDNEYS HOECHST MARION ROUSSEL (FR) 1999-11-02 US disclosed