SCHEMBL30267461

SCHEMBL30267461

O=C1CC2(C1)CN(c1ccn3ncc(C(=O)O)c3n1)C2

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 12/20 0.45
SMPD3 Q9NY59 7/20 0.42
PIM1 P11309 1/20 0.39
PIM2 Q9P1W9 1/20 0.39

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
SCHEMBL30267223 0.90 NTRK1 (0.47) IRAK4SMPD3
SCHEMBL21997557 0.85 IRAK4 (0.47) IRAK4SMPD3
SCHEMBL30267093 0.84 TGFBR1 (0.44) IRAK4
SCHEMBL25339230 0.83 IRAK4 (0.46) IRAK4SMPD3
SCHEMBL25338786 0.83 IRAK4 (0.45) IRAK4
SCHEMBL25339224 0.79 IRAK4 (0.51) IRAK4SMPD3
SCHEMBL25339215 0.79 SMPD3 (0.58) IRAK4SMPD3
SCHEMBL18208677 0.79 SMPD3 (0.62) IRAK4SMPD3
SCHEMBL21996850 0.78 SMPD3 (0.63) IRAK4SMPD3
SCHEMBL21997356 0.76 SMPD3 (0.52) IRAK4SMPD3

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119894895-A IRAK4 degradation agent and application thereof 领泰生物医药(绍兴)有限公司 2025-04-25 CN disclosed
WO-2023025159-A1 IRAK4 DEGRADATION AGENT, AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海领泰生物医药科技有限公司 2023-03-02 WO disclosed
CN-115710274-A IRAK4 degradation agent, preparation method and application thereof 上海领泰生物医药科技有限公司 2023-02-24 CN disclosed