SCHEMBL29047271

SCHEMBL29047271

CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2ccnc2C)c(F)c1

nearest known ligand 0.80

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 13/20 0.80
AGTR1 P30556 1/20 0.61
CYP2C9 P11712 1/20 0.59
CYP2B6 P20813 1/20 0.59

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
SCHEMBL29437891 1.00 AGTR2 (0.80) AGTR2AGTR1CYP2C9CYP2B6
SCHEMBL29437899 0.93 AGTR2 (0.69) AGTR2AGTR1CYP2C9CYP2B6
SCHEMBL29047244 0.93 AGTR2 (0.69) AGTR2AGTR1CYP2C9CYP2B6
SCHEMBL29047325 0.93 AGTR2 (0.69) AGTR2AGTR1CYP2C9CYP2B6
SCHEMBL29437915 0.93 AGTR2 (0.69) AGTR2AGTR1CYP2C9CYP2B6
SCHEMBL29047258 0.93 AGTR2 (0.70) AGTR2AGTR1CYP2C9CYP2B6
SCHEMBL29437901 0.93 AGTR2 (0.70) AGTR2AGTR1CYP2C9CYP2B6
SCHEMBL25247261 0.92 AGTR2 (0.68) AGTR2AGTR1CYP2C9CYP2B6
SCHEMBL29047278 0.92 AGTR2 (0.68) AGTR2AGTR1
SCHEMBL29437896 0.92 AGTR2 (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
CN-116568682-A Novel compounds for the treatment of angiotensin II related diseases 维科尔药物公司 2023-08-08 CN claimed
CN-116568682-A Novel compounds for the treatment of angiotensin II related diseases 维科尔药物公司 2023-08-08 CN disclosed