SCHEMBL28702071

SCHEMBL28702071

[CH2]CCCCNc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 11/20 0.60
▸ IKZF3 Q9UKT9 3/20 0.59
▸ DDB1 Q16531 2/20 0.59
▸ IKZF1 Q13422 2/20 0.59
▸ BRD4 O60885 2/20 0.59
▸ TNF P01375 1/20 0.59
▸ IL1B P01584 1/20 0.59
▸ MAP1LC3B Q9GZQ8 4/20 0.57
▸ STAT3 P40763 1/20 0.53
▸ CSNK1A1 P48729 1/20 0.51
▸ AXL P30530 4/20 0.51

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
SCHEMBL17536561 0.91 CRBN (0.64) CRBNIKZF3DDB1IKZF1BRD4
SCHEMBL2382757 0.90 CRBN (0.60) CRBNIKZF3DDB1IKZF1BRD4
SCHEMBL19436877 0.90 CRBN (0.62) CRBNIKZF3DDB1IKZF1BRD4
SCHEMBL19453060 0.90 CRBN (0.60) CRBNIKZF3DDB1IKZF1BRD4
SCHEMBL30438142 0.90 CRBN (0.62) CRBNIKZF3DDB1IKZF1BRD4
SCHEMBL24142000 0.89 CRBN (0.61) CRBNIKZF3DDB1IKZF1BRD4
SCHEMBL22940891 0.89 CRBN (0.59) CRBNIKZF3DDB1IKZF1BRD4
SCHEMBL21814682 0.89 CRBN (0.61) CRBNIKZF3DDB1IKZF1BRD4
SCHEMBL22959613 0.89 CRBN (0.59) CRBNIKZF3DDB1IKZF1BRD4
SCHEMBL22636509 0.89 CRBN (0.61) CRBNIKZF3DDB1IKZF1BRD4

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
CN-114174299-A Degradation of Bruton's Tyrosine Kinase (BTK) by conjugation of BTK inhibitors to E3 ligase ligands and methods of use 百济神州有限公司 2022-03-11 — — CN disclosed
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