SCHEMBL19045144

SCHEMBL19045144

O=C(Nc1cc2c(cc1N1CCC(CO)CC1)O[C@](CCO)(C(F)(F)F)C2)c1cnn2cccnc12

nearest known ligand 0.92

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 20/20 0.92

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
SCHEMBL20531257 0.96 IRAK4 (1.00) IRAK4
SCHEMBL19045139 0.96 IRAK4 (1.00) IRAK4
SCHEMBL19045140 0.96 IRAK4 (1.00) IRAK4
SCHEMBL19030674 0.88 IRAK4 (1.00) IRAK4
SCHEMBL19030142 0.87 IRAK4 (1.00) IRAK4
SCHEMBL19030825 0.87 IRAK4 (1.00) IRAK4
SCHEMBL19030103 0.87 IRAK4 (1.00) IRAK4
SCHEMBL19030098 0.86 IRAK4 (1.00) IRAK4
SCHEMBL19030661 0.86 IRAK4 (1.00) IRAK4
SCHEMBL19030152 0.86 IRAK4 (1.00) IRAK4

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
WO-2017108723-A2 PYRAZOLO[1,5a]PYRIMIDINE DERIVATIVES AS IRAK4 MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2017-06-29 — — WO disclosed
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