SCHEMBL9616614

SCHEMBL9616614

CCc1nc(=O)c(Cl)c(C(=O)O)n1Cc1c2ccocc-2c(Br)c1-c1ccccc1-c1nnn[nH]1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 6/20 0.32
AGTR2 P50052 4/20 0.31

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
SCHEMBL9616346 0.94 AGTR1 (0.37) AGTR1AGTR2
SCHEMBL9309518 0.92 AGTR1 (0.38) AGTR1AGTR2
SCHEMBL9859908 0.90 AGTR1 (0.32) AGTR1AGTR2
Hydrochloric Acid SCHEMBL9309853 0.89 AGTR1 (0.31) AGTR1AGTR2
SCHEMBL8547883 0.87 PPARG (0.32) AGTR1AGTR2
SCHEMBL9309262 0.87 AGTR1 (0.42) AGTR1AGTR2
SCHEMBL9310782 0.86 AGTR1 (0.32) AGTR1AGTR2
SCHEMBL9616301 0.86
SCHEMBL8547410 0.85 AGTR1 (0.34) AGTR1AGTR2
SCHEMBL9693628 0.85 AGTR1 (0.32) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0514192-A1 Antihypertensive benzofuran derivatives, substituted by varied N-pyrimidinyl- or N-imidazolyl-methyl groups GLAXO GROUP LIMITED (GB) 1992-11-19 EP claimed
EP-0514192-A1 Antihypertensive benzofuran derivatives, substituted by varied N-pyrimidinyl- or N-imidazolyl-methyl groups GLAXO GROUP LIMITED (GB) 1992-11-19 EP disclosed