SCHEMBL8552894

SCHEMBL8552894

CCCCc1nc(SC)c(OC(=O)O)n1Cc1ccc(-c2ccccc2S(=O)(=O)NC(=O)OCc2ccccc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 7/20 0.62
AGTR1 P30556 6/20 0.62

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
SCHEMBL7022847 0.95 AGTR2 (0.61) AGTR2AGTR1
SCHEMBL8551982 0.94 AGTR2 (0.62) AGTR2AGTR1
SCHEMBL8555501 0.91 AGTR1 (0.61) AGTR2AGTR1
SCHEMBL8345878 0.90 AGTR1 (0.78) AGTR2AGTR1
SCHEMBL9565544 0.89 AGTR2 (0.61) AGTR2AGTR1
SCHEMBL7020094 0.89 AGTR2 (0.61) AGTR2AGTR1
SCHEMBL7026152 0.89 AGTR2 (0.61) AGTR2AGTR1
SCHEMBL8557077 0.88 AGTR2 (0.62) AGTR2AGTR1
SCHEMBL7026217 0.88 AGTR2 (0.63) AGTR2AGTR1
SCHEMBL8969857 0.88 AGTR1 (0.68) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0503162-B1 Azole derivatives, process for their preparation and their application HOECHST AG (DE) 1998-04-22 EP disclosed
EP-0503162-A1 Azole derivatives, process for their preparation and their application HOECHST AKTIENGESELLSCHAFT (DE) 1992-09-16 EP disclosed