SCHEMBL19743351

SCHEMBL19743351

OC1CCN(c2nc(C(F)(F)c3ccccc3)nc3c2nnn3Cc2ccncc2C2(C(F)(F)F)N=N2)C1

nearest known ligand 0.69

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 20/20 0.69
CNR1 P21554 5/20 0.65

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
SCHEMBL20952078 1.00 CNR2 (0.69) CNR2CNR1
SCHEMBL19744032 0.94 CNR2 (0.69) CNR2CNR1
SCHEMBL19744017 0.89 CNR2 (0.67) CNR2CNR1
SCHEMBL20951640 0.88 CNR2 (0.69) CNR2CNR1
SCHEMBL19743566 0.88 CNR2 (0.69) CNR2CNR1
SCHEMBL20952141 0.86 CNR2 (0.73) CNR2CNR1
SCHEMBL19743292 0.86 CNR2 (0.73) CNR2CNR1
SCHEMBL20943742 0.84 CNR2 (0.69) CNR2CNR1
SCHEMBL19743567 0.83 CNR2 (0.67) CNR2CNR1
SCHEMBL19743558 0.82 CNR2 (0.69) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3475280-A1 NOVEL [1,2,3]TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES H. Hoffnabb-La Roche Ag (CH) 2019-05-01 EP claimed
WO-2017220516-A1 NOVEL [1,2,3]TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2017-12-28 WO claimed
EP-3475280-A1 NOVEL [1,2,3]TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES H. Hoffnabb-La Roche Ag (CH) 2019-05-01 EP disclosed
WO-2017220516-A1 NOVEL [1,2,3]TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2017-12-28 WO disclosed