SCHEMBL16848418

SCHEMBL16848418

Cc1nonc1Cn1nc2nc(C(C)(C)C)nc(N3CC[C@H](C=O)[C@H]3CO)c2n1

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 20/20 0.46
CNR1 P21554 1/20 0.38

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
SCHEMBL14974265 0.88 CNR2 (0.48) CNR2CNR1
SCHEMBL14974263 0.88 CNR2 (0.48) CNR2CNR1
SCHEMBL14973976 0.76 CNR2 (0.66) CNR2CNR1
SCHEMBL14973974 0.76 CNR2 (0.66) CNR2CNR1
SCHEMBL14977554 0.76 CNR2 (0.52) CNR2CNR1
SCHEMBL14985449 0.75 CNR2 (0.53) CNR2CNR1
SCHEMBL14977377 0.72 CNR2 (0.43) CNR2CNR1
SCHEMBL14974046 0.71 CNR2 (0.66) CNR2CNR1
SCHEMBL14974385 0.71 CNR2 (0.66) CNR2CNR1
SCHEMBL14974047 0.71 CNR2 (0.66) CNR2CNR1

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
US-9067943-B2 [1,2,3]triazolo[4,5-D]pyrimidine derivatives HOFFMANN-LA ROCHE INC. (US) 2015-06-30 US claimed