SCHEMBL9309941

SCHEMBL9309941

CCOC(=O)c1c(Cl)nc(CC)n1Cc1ccc2oc(-c3ccccc3-c3nnn[nH]3)c(Br)c2c1

nearest known ligand 0.58

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 1/20 0.58

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
SCHEMBL9310374 0.94 AGTR1 (0.62) AGTR1
SCHEMBL9310289 0.93 AGTR1 (0.61) AGTR1
SCHEMBL9309276 0.93 AGTR1 (0.68) AGTR1
Hydrochloric Acid SCHEMBL9310039 0.93 AGTR1 (0.51) AGTR1
SCHEMBL9308530 0.93 AGTR1 (0.54) AGTR1
SCHEMBL9310996 0.92 AGTR1 (0.54) AGTR1
SCHEMBL9312874 0.91 AGTR1 (0.54) AGTR1
SCHEMBL9309504 0.91 AGTR1 (0.67) AGTR1
SCHEMBL9694906 0.90 AGTR1 (0.52) AGTR1
SCHEMBL9693548 0.89 AGTR1 (0.52) AGTR1

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
CN-1052672-A Benzofuran derivative GLAXO GROUP LTD (GB) 1991-07-03 CN claimed
EP-0434249-A2 Benzofuran derivatives GLAXO GROUP LIMITED (GB) 1991-06-26 EP claimed
US-5374646-A Treatment or prophylasix of hypertension and diseases associated with cognitive disorders GLAXO GROUP LIMITED (GB) 1994-12-20 US disclosed
CN-1052672-A Benzofuran derivative GLAXO GROUP LTD (GB) 1991-07-03 CN disclosed
EP-0434249-A2 Benzofuran derivatives GLAXO GROUP LIMITED (GB) 1991-06-26 EP disclosed