SCHEMBL6010304

SCHEMBL6010304

CN(CC1CCCN1Cc1ccncc1)c1cc2nc(-c3ccco3)nn2c(N)n1

nearest known ligand 0.75

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 4/20 0.53

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
SCHEMBL5652859 0.92 ADORA2A (0.51) ADORA2A
SCHEMBL5652733 0.88 ADORA2A (0.51) ADORA2A
SCHEMBL5652222 0.86 ADORA2A (0.54) ADORA2A
SCHEMBL5653293 0.86 ADORA2A (0.50) ADORA2A
SCHEMBL5652217 0.83 ADORA2A (0.53) ADORA2A
SCHEMBL5654463 0.82
SCHEMBL6009805 0.77
SCHEMBL5656150 0.76 ADORA2A (0.57) ADORA2A
SCHEMBL5421817 0.76 ADORA2A (0.56) ADORA2A
SCHEMBL6010221 0.75 ADORA2A (0.60) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1618109-A2 TRIAZOLO[1,5-C]PYRIMIDINES AND PYRAZOLO[1,5-C]PYRIMIDINES USEFUL AS A2A ADENOSINE RECEPTOR ANTAGONISTS Biogen Idec MA Inc. (US) 2006-01-25 EP claimed
WO-2004092172-A2 TRIAZOLO[1,5-C]PYRIMIDINES AND PYRAZOLO[1,5-C]PYRIMIDINES USEFUL AS A2A ADENOSIN E RECEPTOR ANTAGONISTS BIOGEN IDEC MA INC. (US) 2004-10-28 WO claimed