SCHEMBL30189622

SCHEMBL30189622

O=C(O)CCOCCOCCOCCNc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 4/20 0.67
CRBN Q96SW2 8/20 0.65
DDB1 Q16531 6/20 0.65
CA2 P00918 2/20 0.63
DYRK2 Q92630 1/20 0.62
SIRT2 Q8IXJ6 2/20 0.58
SIRT1 Q96EB6 2/20 0.58
HDAC1 Q13547 2/20 0.57
HDAC6 Q9UBN7 1/20 0.57
BCL2 P10415 1/20 0.57
MCL1 Q07820 1/20 0.57
HPGDS O60760 1/20 0.56
HDAC3 O15379 1/20 0.56
HDAC2 Q92769 1/20 0.56
NCOR2 Q9Y618 1/20 0.56
PDE6D O43924 1/20 0.55

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
SCHEMBL20242353 1.00 STAT3 (0.67) STAT3CRBNDDB1CA2DYRK2
SCHEMBL20242692 1.00 STAT3 (0.67) STAT3CRBNDDB1CA2DYRK2
SCHEMBL22828152 1.00 STAT3 (0.67) STAT3CRBNDDB1CA2DYRK2
SCHEMBL20242719 1.00 STAT3 (0.67) STAT3CRBNDDB1CA2DYRK2
SCHEMBL23702524 1.00 STAT3 (0.67) STAT3CRBNDDB1CA2DYRK2
SCHEMBL20913682 1.00 STAT3 (0.67) STAT3CRBNDDB1CA2DYRK2
SCHEMBL23702538 1.00 STAT3 (0.67) STAT3CRBNDDB1CA2DYRK2
SCHEMBL21271726 1.00 STAT3 (0.67) STAT3CRBNDDB1CA2DYRK2
SCHEMBL22828168 1.00 STAT3 (0.67) STAT3CRBNDDB1CA2DYRK2
SCHEMBL21271665 1.00 STAT3 (0.67) STAT3CRBNDDB1CA2DYRK2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115611902-B Protein degradation compound designed based on Bruton tyrosine kinase ligand and application thereof 标新生物医药科技(上海)有限公司 2024-11-22 CN disclosed
WO-2023284703-A1 PROTEIN DEGRADATION COMPOUND DESIGNED ON THE BASIS OF BRUTON'S TYROSINE KINASE LIGAND AND APPLICATION THEREOF 标新生物医药科技(上海)有限公司 2023-01-19 WO disclosed
CN-115611902-A Protein degradation compound designed based on Bruton's tyrosine kinase ligand and application thereof 标新生物医药科技(上海)有限公司 2023-01-17 CN disclosed