SCHEMBL8353149

SCHEMBL8353149

CCCCc1nc(SC)cn1Cc1ccc(-c2ccccc2S(=O)(=O)N=CN(C)C)cc1

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 5/20 0.43
AGTR2 P50052 5/20 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
SCHEMBL7613405 0.84 AGTR1 (0.47) AGTR1AGTR2
SCHEMBL8353137 0.83 OPRM1 (0.37) AGTR1AGTR2
SCHEMBL8353003 0.82 AGTR1 (0.53) AGTR1AGTR2
SCHEMBL7609257 0.79 AGTR1 (0.49) AGTR1AGTR2
SCHEMBL7611021 0.78 GP6 (0.58) AGTR1AGTR2
SCHEMBL7611012 0.78 GP6 (0.58) AGTR1AGTR2
SCHEMBL8976542 0.77 AGTR1 (0.57) AGTR1AGTR2
SCHEMBL8976548 0.77 AGTR1 (0.57) AGTR1AGTR2
SCHEMBL7491435 0.75 AGTR2 (0.42) AGTR1AGTR2
SCHEMBL7492382 0.74 AGTR2 (0.45) 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 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