SCHEMBL4778758

SCHEMBL4778758

O=C1CCC(NC(=O)c2cc3ccccc3cc2C(=O)O)C(=O)N1

nearest known ligand 0.66

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 20/20 0.66
DDB1 Q16531 4/20 0.66
IKZF3 Q9UKT9 1/20 0.53
BRD4 O60885 2/20 0.50

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
SCHEMBL2172601 0.89 CRBN (0.66) CRBNDDB1IKZF3BRD4
SCHEMBL4778728 0.87 CRBN (0.74) CRBNDDB1IKZF3BRD4
SCHEMBL4776643 0.85 CRBN (0.65) CRBNDDB1IKZF3BRD4
SCHEMBL23812319 0.81 CRBN (0.69) CRBNDDB1IKZF3BRD4
SCHEMBL20773238 0.80 CRBN (1.00) CRBNDDB1IKZF3
SCHEMBL5742534 0.80 CRBN (1.00) CRBNDDB1IKZF3
SCHEMBL19370841 0.80 CRBN (1.00) CRBNDDB1IKZF3
SCHEMBL20811963 0.79 CRBN (0.74) CRBNDDB1IKZF3BRD4
SCHEMBL19359322 0.79 CRBN (0.69) CRBNDDB1IKZF3BRD4
SCHEMBL20812494 0.78 CRBN (0.67) CRBNDDB1IKZF3BRD4

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