SCHEMBL25235773

SCHEMBL25235773

Nc1ccc(N2CCN(Cc3cccc4c3CN(C3CCC(C(=O)C=O)NC3)C4=O)CC2)cn1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 17/20 0.44
▸ IKZF3 Q9UKT9 17/20 0.44
▸ CHRNB2 P17787 1/20 0.33
▸ CHRNA4 P43681 1/20 0.33
▸ DDB1 Q16531 3/20 0.33
▸ DRD2 P14416 1/20 0.33
▸ ADRA1D P25100 1/20 0.33
▸ ADRA1A P35348 1/20 0.33
▸ ADRA1B P35368 1/20 0.33
▸ PARP1 P09874 2/20 0.32
▸ TNKS O95271 1/20 0.32
▸ PARP6 Q2NL67 1/20 0.32
▸ PARP2 Q9UGN5 1/20 0.32
▸ PARP3 Q9Y6F1 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
SCHEMBL25270702 0.84 CRBN (0.38) CRBNIKZF3PARP1TNKSPARP6
SCHEMBL30458487 0.82 CRBN (0.42) CRBNIKZF3PARP1
SCHEMBL25420904 0.82 HTR2A (0.39) CRBNIKZF3DDB1DRD2ADRA1D
SCHEMBL25421495 0.81 VEGFA (0.39) CRBNIKZF3DDB1DRD2ADRA1D
SCHEMBL25421297 0.78 CRBN (0.36) CRBNIKZF3DDB1PARP1PARP2
SCHEMBL25423768 0.78 CRBN (0.36) CRBNIKZF3DDB1PARP1PARP2
SCHEMBL25647408 0.78 CRBN (0.62) CRBNIKZF3DDB1DRD2ADRA1D
SCHEMBL25423775 0.77 HTR2C (0.39) CRBNIKZF3DDB1PARP1PARP2
SCHEMBL25419396 0.77 HTR2C (0.39) CRBNIKZF3DDB1PARP1
SCHEMBL25231071 0.77 MAPK1 (0.38) CRBNIKZF3DDB1PARP1

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-2023104155-A1 LIGAND COMPOUNDS FOR E3 UBIQUITIN LIGASE, PROTEIN DEGRADERS DEVELOPED ON BASIS OF LIGAND COMPOUNDS, AND USES THEREOF 标新生物医药科技(上海)有限公司 2023-06-15 — — WO claimed
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