SCHEMBL19044683

SCHEMBL19044683

CC1(C)Cc2cc(NC(=O)c3cnn4cccnc34)c(C3COCOC3)cc2O1

nearest known ligand 0.79

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 20/20 0.79

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
SCHEMBL19029946 0.91 IRAK4 (0.90) IRAK4
SCHEMBL19045910 0.91 IRAK4 (0.81) IRAK4
SCHEMBL19030722 0.88 IRAK4 (1.00) IRAK4
SCHEMBL19030712 0.88 IRAK4 (1.00) IRAK4
SCHEMBL29935090 0.87 IRAK4 (1.00) IRAK4
SCHEMBL19030582 0.87 IRAK4 (1.00) IRAK4
SCHEMBL19030122 0.87 IRAK4 (1.00) IRAK4
SCHEMBL19030115 0.87 IRAK4 (1.00) IRAK4
SCHEMBL19030394 0.86 IRAK4 (0.86) IRAK4
SCHEMBL19045334 0.85 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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