SCHEMBL6863123

SCHEMBL6863123

COCCN(CCOC)C(=O)c1cc(N)n2nc(-c3ccc(Cl)o3)nc2c1

nearest known ligand 0.60

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 20/20 0.60

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
SCHEMBL6872908 0.89 ADORA2A (0.77) ADORA2A
SCHEMBL6871702 0.87 ADORA2A (0.77) ADORA2A
SCHEMBL6869558 0.84 ADORA2A (0.82) ADORA2A
SCHEMBL6869719 0.84 ADORA2A (0.61) ADORA2A
SCHEMBL6871980 0.82 ADORA2A (0.79) ADORA2A
SCHEMBL6867105 0.82 ADORA2A (0.66) ADORA2A
SCHEMBL6871247 0.81 ADORA2A (0.53) ADORA2A
SCHEMBL6869682 0.80 ADORA2A (0.62) ADORA2A
SCHEMBL6870601 0.80 ADORA2A (0.65) ADORA2A
SCHEMBL6863081 0.80 ADORA2A (0.64) ADORA2A

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
EP-1347974-B1 AMINOTRIAZOLOPYRIDIINE DERIVATIVES AS ADENOSINE RECEPTOR LIGANDS HOFFMANN LA ROCHE (CH) 2004-11-03 EP disclosed