SCHEMBL19046016

SCHEMBL19046016

CC1(C)CCN(c2cc3c(cc2NC(=O)c2cnn4cccnc24)CC(C)(C)O3)C1

nearest known ligand 0.88

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 20/20 0.88

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
SCHEMBL19044584 0.94 IRAK4 (1.00) IRAK4
SCHEMBL19045312 0.94 IRAK4 (1.00) IRAK4
SCHEMBL19030517 0.92 IRAK4 (1.00) IRAK4
SCHEMBL19030808 0.92 IRAK4 (1.00) IRAK4
SCHEMBL19030852 0.92 IRAK4 (1.00) IRAK4
SCHEMBL19045778 0.92 IRAK4 (1.00) IRAK4
SCHEMBL29935332 0.92 IRAK4 (1.00) IRAK4
SCHEMBL19044585 0.92 IRAK4 (1.00) IRAK4
SCHEMBL29935067 0.91 IRAK4 (1.00) IRAK4
SCHEMBL19045111 0.91 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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