SCHEMBL29013201

SCHEMBL29013201

NC(=O)OC1CC(NCC2CCN(c3ccc(C4CCC(=O)NC4=O)cc3F)CC2)C1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 15/20 0.37
DDB1 Q16531 13/20 0.37
IKZF3 Q9UKT9 1/20 0.33
GSPT1 P15170 1/20 0.33
POLB P06746 1/20 0.32
ESR1 P03372 1/20 0.32
NPY2R P49146 1/20 0.31
KDM1A O60341 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31

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
SCHEMBL25335434 0.86 CRBN (0.37) CRBNDDB1GSPT1ESR1NPY2R
SCHEMBL25035469 0.83 CRBN (0.39) CRBNDDB1GSPT1POLBNPY2R
SCHEMBL25031444 0.83 DDB1 (0.45) CRBNDDB1ESR1NPY2RKDM1A
SCHEMBL30981022 0.83 DDB1 (0.45) CRBNDDB1ESR1NPY2RKDM1A
SCHEMBL25253102 0.81 NPY2R (0.39) CRBNDDB1GSPT1NPY2RKDM1A
SCHEMBL30479015 0.81 CRBN (0.38) CRBNDDB1IKZF3GSPT1POLB
SCHEMBL25822081 0.81 DDB1 (0.45) CRBNDDB1NPY2RKDM1A
SCHEMBL30981345 0.80 CRBN (0.44) CRBNDDB1GSPT1POLB
SCHEMBL24670689 0.78 CRBN (0.44) CRBNDDB1GSPT1POLBESR1
SCHEMBL30135729 0.78 CRBN (0.44) CRBNDDB1GSPT1POLBESR1

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-116261458-B PLK1 degradation inducing compounds 厄普特拉株式会社 2024-05-24 CN disclosed
CN-116261458-A Novel PLK1 degradation inducing compounds 厄普特拉株式会社 2023-06-13 CN disclosed