SCHEMBL19746282

SCHEMBL19746282

C#Cc1cccc(C2=NN2C(F)(F)F)c1Cn1nc2nc(C(F)(F)c3ccccc3)nc(N3CC[C@H](O)C3)c2n1

nearest known ligand 0.73

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 20/20 0.73
CNR1 P21554 3/20 0.41

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
SCHEMBL19743398 0.84 CNR2 (1.00) CNR2CNR1
SCHEMBL19743399 0.84 CNR2 (1.00) CNR2CNR1
SCHEMBL28574523 0.84 CNR2 (0.83) CNR2CNR1
SCHEMBL20962822 0.84 CNR2 (0.83) CNR2CNR1
SCHEMBL19743417 0.74 CNR2 (1.00) CNR2CNR1
SCHEMBL19743415 0.74 CNR2 (1.00) CNR2CNR1
SCHEMBL20962818 0.74 CNR2 (0.82) CNR2CNR1
SCHEMBL28575511 0.74 CNR2 (0.82) CNR2
SCHEMBL19743448 0.72 CNR2 (1.00) CNR2CNR1
SCHEMBL20962806 0.71 CNR2 (0.84) 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 2 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 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