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SCHEMBL6545773

SCHEMBL6545773

CCCCc1nc(SC)c(C(C)(O)C(=O)O)n1Cc1ccc(-c2ccccc2S(=O)(=O)NC(=O)NCCC)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ AGTR2 P50052 9/20 1.00
▸ AGTR1 P30556 2/20 0.78

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
SCHEMBL6545033 0.89 AGTR2 (1.00) AGTR2AGTR1
SCHEMBL8976602 0.88 AGTR2 (1.00) AGTR2AGTR1
SCHEMBL7701057 0.88 AGTR2 (1.00) AGTR2AGTR1
Potassium SCHEMBL8976441 0.87 AGTR2 (0.98) AGTR2AGTR1
SCHEMBL8976768 0.87 AGTR2 (0.98) AGTR2AGTR1
SCHEMBL8348232 0.87 AGTR2 (0.90) AGTR2AGTR1
SCHEMBL7706134 0.87 AGTR2 (0.81) AGTR2AGTR1
SCHEMBL6545647 0.87 AGTR2 (0.78) AGTR2AGTR1
SCHEMBL8352503 0.87 AGTR2 (0.77) AGTR2AGTR1
SCHEMBL7701060 0.86 AGTR2 (0.80) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0748315-B1 USE OF IMIDAZOLE DERIVATIVES FOR TREATING DISORDERS INVOLVING ANGIOTENSIN RECEPTORS AT1 AND AT2, THESE PRODUCTS, PREPARATION THEREOF, USE THEREOF AS DRUGS, AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME AVENTIS PHARMA SA (FR) 2004-01-07 — — EP claimed