SCHEMBL28074704

SCHEMBL28074704

Cc1ccc2c(c1)C(=O)C(=O)N2Cc1cccc(F)c1

nearest known ligand 0.70

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.68
CA2 P00918 2/20 0.68
CA9 Q16790 2/20 0.68
ACHE P22303 2/20 0.62
HSP90AA1 P07900 1/20 0.62
TP53 P04637 3/20 0.56
MAPT P10636 2/20 0.56
UBE2N P61088 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
ALDH1A1 P00352 3/20 0.54
ALDH3A1 P30838 3/20 0.54
CHRM5 P08912 1/20 0.53
PARK7 Q99497 2/20 0.52
ALDH2 P05091 2/20 0.52
CA12 O43570 1/20 0.52

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
SCHEMBL9094274 0.85 ALDH1A1 (0.62) CA1CA2CA9HSP90AA1MAPT
SCHEMBL22410741 0.85 ACHE (0.75) CA1CA2CA9ACHEHSP90AA1
SCHEMBL578250 0.85 ACHE (0.74) CA1CA2CA9ACHEHSP90AA1
SCHEMBL28053291 0.84 ACHE (0.74) CA1CA2CA9ACHEHSP90AA1
SCHEMBL13627923 0.84 UBE2N (0.52) CA1CA2CA9ACHEHSP90AA1
SCHEMBL18974298 0.83 ALDH1A1 (0.73) CA1CA2CA9ACHETP53
SCHEMBL16329852 0.82 ACHE (0.83) CA1CA2CA9ACHEHSP90AA1
SCHEMBL18954644 0.81 CA1 (0.78) CA1CA2CA9UBE2NTDP1
SCHEMBL578265 0.79 PARK7 (0.74) CA1CA2CA9ALDH1A1ALDH3A1
SCHEMBL18974299 0.78 ALDH1A1 (0.69) CA1CA9ACHETP53MAPT

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
CN-105732476-A Carbazole-isatin type compound and preparation method and application thereof 吉首大学 2016-07-06 CN disclosed