SCHEMBL7939376

SCHEMBL7939376

CCCCC(=O)Nc1cc2nc(CCCC)n(Cc3ccc(-c4ccccc4S(=O)(=O)NC(=O)O)cc3)c2nc1C

nearest known ligand 0.84

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 1/20 0.54

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
SCHEMBL9485256 0.96 AGTR1 (0.55) AGTR2
SCHEMBL9270770 0.94 AGTR1 (0.54) AGTR2
SCHEMBL9486098 0.94 AGTR2 (0.63) AGTR2
SCHEMBL9484924 0.92 AGTR2 (0.60) AGTR2
SCHEMBL9483971 0.92 EDNRA (0.51)
SCHEMBL9130314 0.92 AGTR1 (0.55) AGTR2
SCHEMBL9131720 0.92 AGTR1 (0.63) AGTR2
SCHEMBL9489770 0.91 EDNRA (0.49)
SCHEMBL9272898 0.89 AGTR1 (0.53) AGTR2
SCHEMBL9287213 0.87 AGTR1 (0.46) AGTR2

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
US-6218414-B1 ADMINISTERING AN EFFECTIVE AMOUNT OF AN ANGIOTENSIN II ANTAGONIST AND A BENZOFURAN DERIVATIVE WITH ANTIARRHYTHMIC ACTIVITY FOR THERAPY OF CARDIOVASCULAR COMPLAINTS SANOFI (FR) 2001-04-17 US disclosed