SCHEMBL6567320

SCHEMBL6567320

CCCCc1nc2ccc(NC(=O)NC3CCCCC3)cc2n1Cc1ccc(-c2ccccc2OC(=O)O)cc1

nearest known ligand 0.82

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 1/20 0.82
AGTR2 P50052 1/20 0.82

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
Trifluoroacetic Acid SCHEMBL9041880 0.96 AGTR1 (0.76) AGTR1AGTR2
SCHEMBL9042546 0.93 AGTR1 (0.71) AGTR1AGTR2
SCHEMBL9042684 0.91 AGTR1 (0.74) AGTR1AGTR2
Trifluoroacetic Acid SCHEMBL9044417 0.91 AGTR1 (0.67) AGTR1AGTR2
SCHEMBL9043339 0.91 AGTR1 (0.73) AGTR1AGTR2
SCHEMBL9040872 0.90 AGTR1 (0.67) AGTR1AGTR2
SCHEMBL9041554 0.90 AGTR1 (0.67) AGTR1AGTR2
SCHEMBL9040646 0.90 AGTR2 (0.73) AGTR1AGTR2
SCHEMBL6567316 0.90 AGTR1 (1.00) AGTR1AGTR2
SCHEMBL9044581 0.90 AGTR1 (0.66) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0724387-B1 ANGIOTENSION II RECEPTOR ANTAGONISTS FOR THE TREATMENT OF CHRONIC ANTI-INFLAMMATORY DISEASES SMITHKLINE BEECHAM CORP (US) 2003-05-02 EP claimed
EP-0392317-B1 Benzimidazoles, drugs containing these compounds and process for their preparation THOMAE GMBH DR K (DE) 1996-01-03 EP claimed
EP-0392317-A2 Benzimidazoles, drugs containing these compounds and process for their preparation Dr. Karl Thomae GmbH (DE) 1990-10-17 EP claimed
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