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Sugi Predict / Compounds / SCHEMBL25251263

SCHEMBL25251263

SCHEMBL25251263

CC(C)Cc1cc(-c2ccc(Cn3ccnc3C(C)(C)C)c(F)c2)c(S(=O)(=O)NOC(=O)NS(=O)(=O)c2sc(CC(C)C)cc2-c2ccc(Cn3ccnc3C(C)(C)C)c(F)c2)s1

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ AGTR2 P50052 20/20 0.61
▸ CYP3A4 P08684 1/20 0.61

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
SCHEMBL29047263 0.93 AGTR2 (0.69) AGTR2CYP3A4
SCHEMBL25258830 0.91 AGTR2 (0.61) AGTR2CYP3A4
SCHEMBL29047248 0.90 AGTR2 (0.61) AGTR2CYP3A4
SCHEMBL25294191 0.90 AGTR2 (0.62) AGTR2CYP3A4
SCHEMBL25290478 0.88 AGTR2 (0.58) AGTR2CYP3A4
SCHEMBL27245320 0.88 AGTR2 (0.57) AGTR2CYP3A4
SCHEMBL25292121 0.87 AGTR2 (0.62) AGTR2CYP3A4
SCHEMBL27081805 0.86 AGTR2 (0.56) AGTR2CYP3A4
SCHEMBL27081967 0.86 AGTR2 (0.56) AGTR2CYP3A4
SCHEMBL25248847 0.86 AGTR2 (0.54) AGTR2CYP3A4

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
EP-4208460-A1 NOVEL COMPOUNDS FOR USE IN THE TREATMENT OF DISEASES ASSOCIATED WITH ANGIOTENSIN II Vicore Pharma AB (SE) 2023-07-12 — — EP disclosed