SCHEMBL9375550

SCHEMBL9375550

CCCCc1nn(-c2ccc([N+](=O)[O-])cc2C(F)(F)F)c(=O)n1Cc1ccc(-c2ccccc2S(=O)(=O)NC(=O)OC(C)(C)C)cc1

nearest known ligand 0.81

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 3/20 0.73
AGTR2 P50052 2/20 0.73

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
SCHEMBL9399295 0.95 AGTR1 (0.78) AGTR1AGTR2
SCHEMBL9374109 0.90 AGTR1 (0.77) AGTR1AGTR2
SCHEMBL9373594 0.90 AGTR1 (0.76) AGTR1AGTR2
SCHEMBL9377635 0.89 AGTR1 (0.87) AGTR1AGTR2
SCHEMBL29486807 0.89 AGTR1 (0.87) AGTR1AGTR2
SCHEMBL9144071 0.89 AGTR1 (0.63) AGTR1
SCHEMBL9145885 0.89
SCHEMBL9373638 0.87 AGTR2 (0.90) AGTR1AGTR2
SCHEMBL9142041 0.87 AGTR1 (0.59) AGTR1
SCHEMBL9399216 0.86 AGTR2 (0.79) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0586513-A1 ACIDIC ARALKYL TRIAZOLE DERIVATIVES ACTIVE AS ANGIOTENSIN II ANTAGONISTS MERCK & CO. INC. (US) 1994-03-16 EP disclosed
US-5281614-A Hypotensive agents, glaucoma or angiotensin antagonists MERCK & CO., INC. (US) 1994-01-25 US disclosed
WO-1992020662-A1 ACIDIC ARALKYL TRIAZOLE DERIVATIVES ACTIVE AS ANGIOTENSIN II ANTAGONISTS MERCK & CO., INC. (US) 1992-11-26 WO disclosed