SCHEMBL7301700

SCHEMBL7301700

CCCCc1nc2ccc(-c3cn4ccccc4n3)cc2n1Cc1ccc(-c2ccccc2C(=O)O)cc1

nearest known ligand 0.72

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 2/20 0.69
AGTR2 P50052 2/20 0.69
PPARG P37231 8/20 0.68

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
SCHEMBL682604 0.95 PPARG (0.71) PPARG
SCHEMBL7301049 0.91 AGTR1 (0.68) AGTR1AGTR2PPARG
SCHEMBL7302124 0.91 PPARG (0.70) AGTR1AGTR2PPARG
SCHEMBL8847810 0.89 AGTR1 (0.55) AGTR1AGTR2PPARG
SCHEMBL7301703 0.89 AGTR1 (0.54) AGTR1AGTR2PPARG
SCHEMBL7301790 0.89 PPARG (0.71) PPARG
SCHEMBL7308234 0.88 AGTR1 (0.61) AGTR1AGTR2PPARG
SCHEMBL7313106 0.85 PPARG (0.60) AGTR1AGTR2PPARG
SCHEMBL8391692 0.85 AGTR1 (0.83) AGTR1AGTR2PPARG
SCHEMBL7054367 0.84 AGTR1 (0.82) AGTR1AGTR2PPARG

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5614519-A (1-(2,3 or 4-N-morpholinoalkyl)-imidazol-4-yl)-benizimidazol-1-yl-methyl]-biphenyls useful as angiotensin-II antagonists KARL THOMAE GMBH (DE) 1997-03-25 US disclosed
US-5602127-A ADMINISTERING TO TREAT HYPERTENSION KARL THOMAE GMBH (DE) 1997-02-11 US disclosed
US-5594003-A HYPOTENSIVE AGENTS DR. KARL THOMAE GMBH (DE) 1997-01-14 US disclosed
US-5591762-A HYPOTENSIVE AGENTS DR. KARL THOMAE GMBH (DE) 1997-01-07 US disclosed
EP-0502314-A1 Benzimidazol, medicaments containing them and process for their preparation Dr. Karl Thomae GmbH (DE) 1992-09-09 EP disclosed