SCHEMBL8347253

SCHEMBL8347253

CCc1nc(SC)c(C(C)(O)C(=O)OC(C)CC)n1Cc1ccc(-c2ccccc2S(=O)(=O)N=CN(C)C)cc1

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 15/20 0.48
AGTR1 P30556 2/20 0.43

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
SCHEMBL8351909 0.83 AGTR2 (0.56) AGTR2
SCHEMBL8353769 0.81 AGTR2 (0.73) AGTR2AGTR1
SCHEMBL8352518 0.81 AGTR2 (0.57) AGTR2AGTR1
SCHEMBL8348329 0.78 AGTR2 (0.72) AGTR2AGTR1
SCHEMBL8353003 0.73 AGTR1 (0.53) AGTR2AGTR1
SCHEMBL8976548 0.73 AGTR1 (0.57) AGTR2AGTR1
SCHEMBL8353008 0.73 AGTR2 (0.53) AGTR2AGTR1
SCHEMBL8976542 0.73 AGTR1 (0.57) AGTR2AGTR1
SCHEMBL8353547 0.72 AGTR2 (0.42) AGTR2AGTR1
SCHEMBL8353137 0.71 OPRM1 (0.37) 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