SCHEMBL19743767

SCHEMBL19743767

OC1CCN(c2nc(C(F)(F)c3ccccc3)nc3nn(Cc4ncccc4C4(C(F)(F)F)N=N4)nc23)C1

nearest known ligand 0.73

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 20/20 0.73
CNR1 P21554 1/20 0.45

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
SCHEMBL20943739 1.00 CNR2 (0.73) CNR2CNR1
SCHEMBL19744375 0.90 CNR2 (0.72) CNR2
SCHEMBL20943807 0.89 CNR2 (0.69) CNR2CNR1
SCHEMBL19743414 0.89 CNR2 (0.69) CNR2CNR1
SCHEMBL19743604 0.88 CNR2 (0.71) CNR2CNR1
SCHEMBL20943742 0.86 CNR2 (0.69) CNR2CNR1
SCHEMBL19744260 0.86 CNR2 (0.69) CNR2CNR1
SCHEMBL19743398 0.84 CNR2 (1.00) CNR2CNR1
SCHEMBL19743399 0.84 CNR2 (1.00) CNR2CNR1
SCHEMBL20952141 0.84 CNR2 (0.73) 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-3475283-A1 NOVEL[1,2,3]TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES H. Hoffnabb-La Roche Ag (CH) 2019-05-01 EP claimed
WO-2017220544-A1 NOVEL[1,2,3]TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2017-12-28 WO claimed
EP-3475283-A1 NOVEL[1,2,3]TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES H. Hoffnabb-La Roche Ag (CH) 2019-05-01 EP disclosed
WO-2017220544-A1 NOVEL[1,2,3]TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2017-12-28 WO disclosed