SCHEMBL8970656

SCHEMBL8970656

C=CCOC(=O)NS(=O)(=O)c1ccccc1-c1ccc(Cn2c(CCCC)nc(SC)c2C(=O)OCC)cc1

nearest known ligand 0.78

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 5/20 0.65
AGTR2 P50052 5/20 0.65

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
SCHEMBL8970000 0.94 AGTR1 (0.70) AGTR1AGTR2
SCHEMBL8555500 0.93 AGTR1 (0.75) AGTR1AGTR2
SCHEMBL8969857 0.90 AGTR1 (0.68) AGTR1AGTR2
SCHEMBL8971339 0.90 AGTR2 (0.71) AGTR1AGTR2
SCHEMBL8902733 0.89 AGTR1 (0.68) AGTR1AGTR2
SCHEMBL8554796 0.89 AGTR2 (0.58) AGTR1AGTR2
SCHEMBL8555501 0.87 AGTR1 (0.61) AGTR1AGTR2
SCHEMBL8898987 0.86 AGTR2 (0.83) AGTR1AGTR2
SCHEMBL8903171 0.86 AGTR1 (0.66) AGTR1AGTR2
SCHEMBL8970663 0.86 AGTR2 (0.55) 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-5482957-A Azole derivatives, process for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1996-01-09 US disclosed