SCHEMBL6566415

SCHEMBL6566415

CCCCc1nc(Cl)c(CO)n1Cc1ccc(-c2ccccc2OC(=O)O)cc1

nearest known ligand 0.74

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 4/20 0.74
AGTR1 P30556 3/20 0.74

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
SCHEMBL7706072 0.87 AGTR1 (0.57) AGTR2AGTR1
SCHEMBL89 0.85 AGTR1 (1.00) AGTR2AGTR1
SCHEMBL29486822 0.85 AGTR1 (1.00) AGTR2AGTR1
SCHEMBL9468476 0.84 AGTR1 (0.98) AGTR2AGTR1
SCHEMBL9041377 0.83 AGTR1 (0.74) AGTR2AGTR1
SCHEMBL9042978 0.83 PPARG (0.60) AGTR2AGTR1
SCHEMBL9704742 0.83 AGTR1 (0.55) AGTR2AGTR1
SCHEMBL9042283 0.83 AGTR1 (0.62) AGTR2AGTR1
SCHEMBL462 0.83 AGTR2 (0.80) AGTR2AGTR1
SCHEMBL9704687 0.83 AGTR2 (0.53) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1014989-B1 ENDOTHELIN ANTAGONIST AND A RENIN-ANGIOTENSIN SYSTEM INHIBITOR AS A COMBINED PREPARATION ABBOTT GMBH & CO KG (DE) 2004-01-14 EP disclosed
EP-0634175-B1 Pharmaceutical combination, containing a renin-angiotensin-system inhibitor and an endothelin antagonist HOFFMANN LA ROCHE (CH) 2001-01-10 EP disclosed
EP-0634175-A1 Pharmaceutical combination, containing a renin-angiotensin-system inhibitor and an endothelin antagonist F. HOFFMANN-LA ROCHE AG (CH) 1995-01-18 EP disclosed