SCHEMBL8527256

SCHEMBL8527256

O=C(O)Cn1cnc2c(NC(=O)COc3ccccc3)ncnc21

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.49
PDE4A P27815 1/20 0.47
PDE4B Q07343 1/20 0.47
PDE4C Q08493 1/20 0.47
PDE4D Q08499 1/20 0.47
HDAC1 Q13547 4/20 0.46
HDAC2 Q92769 4/20 0.46
GAA P10253 1/20 0.46
NPC1 O15118 4/20 0.45
RAB9A P51151 4/20 0.45
HPGD P15428 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
FLT4 P35916 1/20 0.45
KDR P35968 1/20 0.45
EGFR P00533 1/20 0.45
ALPL P05186 1/20 0.44
TP53 P04637 1/20 0.44
THRB P10828 1/20 0.44
LMNA P02545 1/20 0.44

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
SCHEMBL8527919 0.82 LMNA (0.47) GAANPC1RAB9AHPGDSMN1; SMN2
SCHEMBL3457849 0.81 EGFR (0.54) TDP1PDE4APDE4BPDE4CPDE4D
SCHEMBL8527262 0.80 ALDH1A1 (0.46) PDE4APDE4BPDE4CPDE4DGAA
SCHEMBL3130095 0.79 TDP1 (0.48) TDP1PDE4APDE4BPDE4CPDE4D
SCHEMBL3133440 0.78 TDP1 (0.43) TDP1PDE4APDE4BPDE4CPDE4D
SCHEMBL30089845 0.78 TDP1 (0.43) TDP1PDE4APDE4BPDE4CPDE4D
SCHEMBL6748343 0.76 HDAC1 (0.58) HDAC1NPC1RAB9AHPGDSMN1; SMN2
SCHEMBL8056331 0.75 FLT4 (0.45) TDP1PDE4APDE4BPDE4CPDE4D
SCHEMBL24540240 0.74 TDP1 (0.42) TDP1PDE4APDE4BPDE4CPDE4D
SCHEMBL5962910 0.73 ADORA3 (0.68) TDP1NPC1RAB9ASMN1; SMN2TP53

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
EP-0885236-A1 OLIGONUCLEOTIDE ANALOGS Codon Pharmaceuticals, Inc. (US) 1998-12-23 EP disclosed
WO-1997027206-A1 OLIGONUCLEOTIDE ANALOGS CODON PHARMACEUTICALS, INC. (US) 1997-07-31 WO disclosed