SCHEMBL4654464

SCHEMBL4654464

CCCCCCCCCCCCOc1c(O)cc(C(=O)c2ccccc2)c(O)c1O

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CCNB2 O95067 1/20 0.51
CCNE2 O96020 1/20 0.51
CDK1 P06493 1/20 0.51
CCNB1 P14635 1/20 0.51
CCNE1 P24864 1/20 0.51
CDK2 P24941 1/20 0.51
CCNB3 Q8WWL7 1/20 0.51
PTPN11 Q06124 1/20 0.44
CNR2 P34972 1/20 0.44
NR1H4 Q96RI1 1/20 0.44
ESR1 P03372 1/20 0.44
AKR1C4 P17516 1/20 0.44
AKR1C3 P42330 1/20 0.44
AKR1C2 P52895 1/20 0.44
AKR1C1 Q04828 1/20 0.44
BCL2 P10415 1/20 0.44
MCL1 Q07820 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
SCHEMBL5470748 1.00 CCNB2 (0.51) CCNB2CCNE2CDK1CCNB1CCNE1
SCHEMBL5480607 1.00 CCNB2 (0.51) CCNB2CCNE2CDK1CCNB1CCNE1
SCHEMBL2799223 1.00 CCNB2 (0.51) CCNB2CCNE2CDK1CCNB1CCNE1
SCHEMBL5474558 1.00 CCNB2 (0.51) CCNB2CCNE2CDK1CCNB1CCNE1
SCHEMBL27589392 0.99 CCNB2 (0.52) CCNB2CCNE2CDK1CCNB1CCNE1
SCHEMBL5478166 0.95 CCNB2 (0.47) CCNB2CCNE2CDK1CCNB1CCNE1
SCHEMBL5478807 0.91 CCNB2 (0.50) CCNB2CCNE2CDK1CCNB1CCNE1
SCHEMBL28488245 0.86 CCNB2 (0.52) CCNB2CCNE2CDK1CCNB1CCNE1
SCHEMBL2801185 0.82 CCNB2 (0.50) CCNB2CCNE2CDK1CCNB1CCNE1
SCHEMBL5154293 0.82 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
EP-1505412-B1 Plastic lens and process for producing the lens HOYA CORP (JP) 2008-11-05 EP claimed