SCHEMBL9318673

SCHEMBL9318673

CCc1nc2c(C)cc(C)nc2n1Cc1ccc2c(-c3cccc(F)c3C(=O)O)oc(Br)c2c1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL9318796 0.92
SCHEMBL9318667 0.90
SCHEMBL9318644 0.89
SCHEMBL9318652 0.87
SCHEMBL9653438 0.86
SCHEMBL9318790 0.82
SCHEMBL9653430 0.82
SCHEMBL9317816 0.82
SCHEMBL9319806 0.81 AGTR1 (0.47)
SCHEMBL9737687 0.81 AGTR1 (0.47)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5317023-A 2-Phenyl-(imidazo(4,5-b)pyridyl-methyl-) derivatives; hypertensive agents; cognition activators GLAXO GROUP LIMITED (GB) 1994-05-31 US disclosed
CN-1074683-A Benzofuran derivative GLAXO GROUP LTD (GB) 1993-07-28 CN disclosed
WO-1992020679-A1 BENZOFURAN DERIVATIVES GLAXO GROUP LIMITED (GB) 1992-11-26 WO disclosed
EP-0514197-A1 Anti-hypertensive benzofuran derivatives substituted by N-imidazolyl-methyl groups which are condensed with optionally nitrogen containing, six-membered rings GLAXO GROUP LIMITED (GB) 1992-11-19 EP disclosed