SCHEMBL30619652

SCHEMBL30619652

CCCC(=O)NCC(C)c1cccc2c1CN(C1CCC(=O)NC1=O)C2=O

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 15/20 0.56
IKZF3 Q9UKT9 6/20 0.52
IKZF1 Q13422 2/20 0.52
BRD4 O60885 2/20 0.52
TNF P01375 1/20 0.52
IL1B P01584 1/20 0.52
DDB1 Q16531 1/20 0.52
CSNK1A1 P48729 1/20 0.52
STAT3 P40763 1/20 0.46
MAP1LC3B Q9GZQ8 2/20 0.45
GSPT1 P15170 1/20 0.45
IKZF2 Q9UKS7 2/20 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
SCHEMBL1962924 0.84 CRBN (0.68) CRBNIKZF3IKZF1BRD4TNF
SCHEMBL25653782 0.84 CRBN (0.65) CRBNIKZF3IKZF1BRD4TNF
SCHEMBL25726981 0.84 CRBN (0.65) CRBNIKZF3IKZF1BRD4TNF
SCHEMBL24765458 0.84 CRBN (0.65) CRBNIKZF3IKZF1BRD4TNF
SCHEMBL27289821 0.82 CRBN (0.56) CRBNIKZF3IKZF1BRD4TNF
SCHEMBL13641027 0.82 CRBN (0.62) CRBNIKZF3IKZF1BRD4TNF
SCHEMBL21107124 0.80 CRBN (0.70) CRBNIKZF3IKZF1BRD4TNF
SCHEMBL21107638 0.80 CRBN (0.70) CRBNIKZF3IKZF1BRD4TNF
SCHEMBL17299698 0.80 CRBN (0.70) CRBNIKZF3IKZF1BRD4TNF
SCHEMBL27289818 0.79 CRBN (0.53) CRBNIKZF3IKZF1BRD4TNF

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
CN-117088864-A Benzo [ d ] isoxazole compound and application thereof 广州智药生物科技有限公司 2023-11-21 CN disclosed
WO-2023217063-A1 BENZO[D]ISOXAZOLE COMPOUND AND USE THEREOF 广州智药生物科技有限公司 2023-11-16 WO disclosed