SCHEMBL29346972

SCHEMBL29346972

O=C1CCCN(c2ccc3ncccc3c2)C(=O)N1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.45
POLB P06746 2/20 0.45
PSMD14 O00487 1/20 0.45
MMP2 P08253 1/20 0.45
CRBN Q96SW2 5/20 0.44
DDB1 Q16531 4/20 0.44
CHRNA7 P36544 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
NCOA3 Q9Y6Q9 1/20 0.43
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.41
HSP90AA1 P07900 1/20 0.41
HSP90AB1 P08238 1/20 0.41
TSHR P16473 1/20 0.41
CASP1 P29466 1/20 0.41
HTT P42858 1/20 0.41
ATM Q13315 1/20 0.41

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
SCHEMBL3781533 0.80 POLB (0.50) TP53POLBPSMD14MMP2CHRNA7
SCHEMBL28874935 0.71 TERT (0.56) TP53POLBPSMD14MMP2CHRNA7
SCHEMBL4215305 0.71 POLB (0.47) TP53POLBPSMD14MMP2CHRNA7
SCHEMBL28306659 0.70 TERT (0.57) TP53POLBPSMD14MMP2CHRNA7
SCHEMBL3783199 0.70 HDAC1 (0.52) TP53POLBPSMD14MMP2CHRNA7
SCHEMBL17185782 0.70 TP53 (0.46) TP53POLBPSMD14MMP2CHRNA7
SCHEMBL13467825 0.70 PSMD14 (0.44) TP53POLBPSMD14MMP2CHRNA7
SCHEMBL27490086 0.70 POLB (0.43) TP53POLBPSMD14MMP2CHRNA7
SCHEMBL30604184 0.69 HDAC1 (0.45) TP53POLBPSMD14MMP2CHRNA7
SCHEMBL22440445 0.69 NCOA3 (0.55) TP53POLBPSMD14MMP2CHRNA7

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-2024150815-A1 CEREBLON E3 LIGASE BINDING COMPOUND, PHARMACEUTICAL COMPOSITION CONTAINING SAME, AND PRODUCTION METHOD THEREFOR 田辺三菱製薬株式会社 2024-07-18 WO disclosed