SCHEMBL2801185

SCHEMBL2801185

CCCCCCCCOc1c(O)c(O)c(C(=O)c2ccccc2)c(O)c1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNB2 O95067 1/20 0.50
CCNE2 O96020 1/20 0.50
CDK1 P06493 1/20 0.50
CCNB1 P14635 1/20 0.50
CCNE1 P24864 1/20 0.50
CDK2 P24941 1/20 0.50
CCNB3 Q8WWL7 1/20 0.50
CES2 O00748 2/20 0.49
CES1 P23141 2/20 0.49
TSHR P16473 2/20 0.48
TP53 P04637 1/20 0.48
PLA2G4B P0C869 1/20 0.47
LMNA P02545 2/20 0.45
ALDH1A1 P00352 1/20 0.45
RARB P10826 3/20 0.44
GSTA1 P08263 1/20 0.44
GSTP1 P09211 1/20 0.44
MEN1 O00255 1/20 0.44
NR1I2 O75469 1/20 0.44
CHRM2 P08172 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
SCHEMBL5474558 0.82 CCNB2 (0.51) CCNB2CCNE2CDK1CCNB1CCNE1
SCHEMBL5480607 0.82 CCNB2 (0.51) CCNB2CCNE2CDK1CCNB1CCNE1
SCHEMBL4654464 0.82 CCNB2 (0.51) CCNB2CCNE2CDK1CCNB1CCNE1
SCHEMBL5470748 0.82 CCNB2 (0.51) CCNB2CCNE2CDK1CCNB1CCNE1
SCHEMBL2799223 0.82 CCNB2 (0.51) CCNB2CCNE2CDK1CCNB1CCNE1
SCHEMBL27589392 0.81 CCNB2 (0.52) CCNB2CCNE2CDK1CCNB1CCNE1
SCHEMBL28488245 0.81 CCNB2 (0.52) CCNB2CCNE2CDK1CCNB1CCNE1
SCHEMBL5829566 0.80 MAPT (0.51) CCNB2CCNE2CDK1CCNB1CCNE1
SCHEMBL295133 0.79 CCNB2 (0.53) CCNB2CCNE2CDK1CCNB1CCNE1
SCHEMBL5154293 0.79 CCNB2 (0.53) CCNB2CCNE2CDK1CCNB1CCNE1

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
US-20100201939-A1 PLASTIC LENS AND METHOD OF MANUFACTURING THE SAME HOYA CORPORATION (JP) 2010-08-12 US disclosed