SCHEMBL31478321

SCHEMBL31478321

Cc1nnc(-c2ccc(CC(=O)NCCOCCOCCOCCN(CCOCCOCCOCCNC(=O)Cc3ccc(-c4nnc(C)nn4)cc3)C(=O)CCOCCOCCN(CCOCCOCCC(=O)N(CCOCCOCCOCCN=[N+]=[N-])CCOCCOCCOCCN=[N+]=[N-])C(=O)NCCOCCOCCOCCNC(=O)OC(C)(C)C)cc2)nn1

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 1/20 0.33
BRD4 O60885 1/20 0.33
BRD2 P25440 1/20 0.33
BRD3 Q15059 1/20 0.33
GBA1 P04062 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
SUCNR1 Q9BXA5 2/20 0.32
KDM4E B2RXH2 1/20 0.30
GLA P06280 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
PLK1 P53350 2/20 0.30

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
SCHEMBL31041096 0.81 CA1 (0.38) CRBNBRD4BRD2BRD3GBA1
SCHEMBL31478285 0.81 HDAC4 (0.43) BRD4BRD2BRD3GBA1HDAC4
SCHEMBL19451363 0.79 CRBN (0.34) CRBNSUCNR1
SCHEMBL29427494 0.77 TDP1 (0.32) PLK1
SCHEMBL29427447 0.77 TDP1 (0.32) PLK1
SCHEMBL31328769 0.77 CRBN (0.33) CRBNSUCNR1
SCHEMBL17284191 0.74 CA12 (0.36) CRBN
SCHEMBL17722876 0.71 CRBN (0.38) CRBNKDM4E
SCHEMBL22109240 0.71 KDM4E (0.44) HDAC4HDAC6KDM4EGLAL3MBTL1
SCHEMBL20904591 0.71 PLK1 (0.38) CRBNPLK1

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
WO-2025083069-A1 HER2-BINDING MOLECULES Hummingbird Bioscience Pte. Ltd. (SG) 2025-04-24 WO disclosed