SCHEMBL30984679

SCHEMBL30984679

O=C1CCC(N2C(=O)c3ccc(N4CCC(CN5CCC(N6CCN(c7ccc([N+](=O)[O-])cc7)CC6)CC5)CC4)cc3C2=O)C(=O)N1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 12/20 0.58
▸ DDB1 Q16531 3/20 0.58
▸ AR P10275 7/20 0.51
▸ IRAK1 P51617 1/20 0.49
▸ IRAK4 Q9NWZ3 1/20 0.49
▸ IRAK3 Q9Y616 1/20 0.49
▸ PLK4 O00444 2/20 0.47
▸ CDK9 P50750 1/20 0.46
▸ BTK Q06187 2/20 0.45
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 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
SCHEMBL30984751 0.90 CRBN (0.60) CRBNDDB1ARIRAK1IRAK4
SCHEMBL30984972 0.89 CRBN (0.60) CRBNDDB1ARIRAK1IRAK4
SCHEMBL31306480 0.87 CRBN (0.53) CRBNDDB1ARIRAK1IRAK4
SCHEMBL30984986 0.87 CRBN (0.62) CRBNDDB1ARMEN1KMT2A
SCHEMBL30985007 0.87 CRBN (0.62) CRBNDDB1ARMEN1KMT2A
SCHEMBL30985127 0.86 CRBN (0.54) CRBNDDB1ARIRAK1IRAK4
SCHEMBL30985141 0.86 CRBN (0.59) CRBNDDB1ARIRAK1IRAK4
SCHEMBL30984990 0.85 CRBN (0.59) CRBNDDB1ARMEN1KMT2A
SCHEMBL30984808 0.85 CRBN (0.59) CRBNDDB1ARIRAK1IRAK4
SCHEMBL28795207 0.85 CRBN (0.47) CRBNDDB1ARIRAK1IRAK4

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-2024146502-A1 WEE1 DEGRADING COMPOUNDS BEIJING NEOX BIOTECH LIMITED (CN) 2024-07-11 — — WO disclosed
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