SCHEMBL31661162

SCHEMBL31661162

C[C@H](C#N)Nc1cc(-n2ncc3cc(C#N)cnc32)ncc1C(=O)NC1CCC(CCO)CC1

nearest known ligand 0.71

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 20/20 0.71

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
SCHEMBL31661190 0.90 IRAK4 (0.73) IRAK4
SCHEMBL17193182 0.83 IRAK4 (1.00) IRAK4
SCHEMBL16887706 0.83 IRAK4 (1.00) IRAK4
SCHEMBL16873042 0.83 IRAK4 (1.00) IRAK4
SCHEMBL16873040 0.83 IRAK4 (1.00) IRAK4
SCHEMBL21948694 0.83 IRAK4 (0.87) IRAK4
SCHEMBL16872986 0.83 IRAK4 (1.00) IRAK4
SCHEMBL16873394 0.82 IRAK4 (1.00) IRAK4
SCHEMBL16873838 0.82 IRAK4 (1.00) IRAK4
SCHEMBL16873836 0.82 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-2025151602-A1 HETEROARYL COMPOUNDS AS LIGAND DIRECTED DEGRADERS OF IRAK4 BRISTOL-MYERS SQUIBB COMPANY (US) 2025-07-17 — — WO disclosed
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