SCHEMBL4793530

SCHEMBL4793530

O=C1CCC(NC(=O)c2cccc([AsH2])c2C(=O)O)C(=O)N1

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 20/20 0.62
DDB1 Q16531 4/20 0.61
BRD4 O60885 2/20 0.54
IKZF3 Q9UKT9 1/20 0.52

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
SCHEMBL4781353 0.85 CRBN (0.77) CRBNDDB1BRD4IKZF3
SCHEMBL4778728 0.83 CRBN (0.74) CRBNDDB1BRD4IKZF3
SCHEMBL4778581 0.80 CRBN (0.73) CRBNDDB1BRD4IKZF3
SCHEMBL20811963 0.78 CRBN (0.74) CRBNDDB1BRD4IKZF3
SCHEMBL26646479 0.78 CRBN (0.77) CRBNDDB1BRD4IKZF3
SCHEMBL23812319 0.78 CRBN (0.69) CRBNDDB1BRD4IKZF3
SCHEMBL19359322 0.78 CRBN (0.69) CRBNDDB1BRD4IKZF3
SCHEMBL21946676 0.77 CRBN (0.61) CRBNDDB1BRD4IKZF3
SCHEMBL20811955 0.77 CRBN (0.72) CRBNDDB1BRD4IKZF3
SCHEMBL17169744 0.77 CRBN (1.00) CRBNDDB1BRD4IKZF3

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-2008007979-A1 (2,6-DIOXO-3-PIPERINYL)AMIDOBENZOIC IMMUNOMODULATORY AND ANTI-CANCER DERIVATIVES AUCKLAND UNISERVICES LIMITED (NZ) 2008-01-17 WO claimed