SCHEMBL28374646

SCHEMBL28374646

O=C1C(Cl)=C(c2cn(Cc3ccccc3)c3ccccc23)C(=O)N1c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 1/20 0.63
PDE4A P27815 7/20 0.48
PDE4B Q07343 7/20 0.48
PDE4C Q08493 7/20 0.48
PDE4D Q08499 7/20 0.48
PDE3B Q13370 5/20 0.48
PDE3A Q14432 5/20 0.48
LMNA P02545 1/20 0.46
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
ESR1 P03372 1/20 0.44
CHRM1 P11229 1/20 0.44
ALDH1A1 P00352 2/20 0.43
MAPT P10636 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
F2RL3 Q96RI0 1/20 0.43
HTR6 P50406 1/20 0.43
MEN1 O00255 1/20 0.43

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
SCHEMBL28369857 0.81 CCNT1 (0.56) LMNAMAPTMEN1KMT2ASMN1; SMN2
SCHEMBL8166825 0.76 SIRT2 (0.68) SIRT2PDE4APDE4BPDE4CPDE4D
SCHEMBL27868039 0.72 SIRT2 (0.66) SIRT2PDE4APDE4BPDE4CPDE4D
SCHEMBL4754296 0.72 SIRT2 (0.61) SIRT2PDE4APDE4BPDE4CPDE4D
SCHEMBL28369506 0.72 GSK3B (0.47) LMNAMAPTMEN1KMT2ASMN1; SMN2
SCHEMBL27811062 0.71 SIRT2 (0.64) SIRT2PDE4APDE4BPDE4CPDE4D
SCHEMBL28375665 0.71 GSK3B (0.44) LMNAALDH1A1MAPTMEN1TSHR
SCHEMBL8167903 0.70 CCNE2 (0.72) SIRT2
SCHEMBL28369252 0.70 GSK3B (0.45) LMNAMAPTMEN1KMT2ASMN1; SMN2
SCHEMBL28369715 0.70 GSK3B (0.45)

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-110862396-B Synthesis method of pyrrolo [3,4-c ] carbazole-1, 3(2H, 6H) -diketone compound 浙江工业大学 2021-06-04 CN disclosed
CN-110862396-A Synthesis method of pyrrolo [3,4-c ] carbazole-1, 3(2H,6H) -diketone compound 浙江工业大学 2020-03-06 CN disclosed