SCHEMBL29773937

SCHEMBL29773937

CC(O)N1CCN(c2nc3c(cc2N)CC(C)(C)O3)CC1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 15/20 0.37
▸ OGA O60502 3/20 0.35
▸ HRH4 Q9H3N8 1/20 0.33
▸ GAA P10253 1/20 0.32

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
SCHEMBL22344222 0.82 IRAK4 (0.38) IRAK4
SCHEMBL21326705 0.81 IRAK4 (0.51) IRAK4GAA
SCHEMBL21326611 0.81 IRAK4 (0.46) IRAK4GAA
SCHEMBL29773991 0.81 IRAK4 (0.37) IRAK4OGA
SCHEMBL21326651 0.80 IRAK4 (0.51) IRAK4
SCHEMBL21326725 0.78 IRAK4 (0.56) IRAK4
SCHEMBL21326696 0.77 IRAK4 (0.51) IRAK4
SCHEMBL21326669 0.76 IRAK4 (0.52) IRAK4
SCHEMBL21326720 0.74 IRAK4 (0.42) IRAK4
SCHEMBL23093807 0.71 CYP1A2 (0.43) 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
CN-109890829-B Pyrazolo [1,5a ] pyrimidine derivatives as IRAK4 modulators 豪夫迈·罗氏有限公司 2022-07-15 — — CN disclosed
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