SCHEMBL19046056

SCHEMBL19046056

CC1(CO)Cc2cc(N)c(N3CCCC3)cc2O1

nearest known ligand 0.44

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 20/20 0.44

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
SCHEMBL28654751 0.90 IRAK4 (0.43) IRAK4
SCHEMBL19029881 0.90 IRAK4 (0.54) IRAK4
SCHEMBL29502480 0.90 IRAK4 (0.54) IRAK4
SCHEMBL19030322 0.88 IRAK4 (0.50) IRAK4
SCHEMBL29935423 0.88 IRAK4 (0.50) IRAK4
SCHEMBL19029928 0.87 IRAK4 (0.51) IRAK4
SCHEMBL30090141 0.87 IRAK4 (0.51) IRAK4
SCHEMBL19030263 0.87 IRAK4 (0.51) IRAK4
SCHEMBL19029892 0.87 IRAK4 (0.51) IRAK4
SCHEMBL19030714 0.84 IRAK4 (0.53) 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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