SCHEMBL28129641

SCHEMBL28129641

CCCCCCCCCCOc1c(O)cccc1C(=O)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNB2 O95067 1/20 0.53
CCNE2 O96020 1/20 0.53
CDK1 P06493 1/20 0.53
CCNB1 P14635 1/20 0.53
CCNE1 P24864 1/20 0.53
CDK2 P24941 1/20 0.53
CCNB3 Q8WWL7 1/20 0.53
TSHR P16473 3/20 0.49
LMNA P02545 2/20 0.49
ALDH1A1 P00352 1/20 0.49
CYP3A4 P08684 2/20 0.48
MEN1 O00255 1/20 0.48
NR1I2 O75469 1/20 0.48
CHRM2 P08172 1/20 0.48
ADRA2A P08913 1/20 0.48
MAPT P10636 1/20 0.48
OPRK1 P41145 1/20 0.48
HTR2B P41595 1/20 0.48
SLC6A3 Q01959 1/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL295133 1.00 CCNB2 (0.53) CCNB2CCNE2CDK1CCNB1CCNE1
SCHEMBL5154293 1.00 CCNB2 (0.53) CCNB2CCNE2CDK1CCNB1CCNE1
SCHEMBL4479542 0.86 LMNA (0.58) CCNB2CCNE2CDK1CCNB1CCNE1
SCHEMBL28488245 0.85 CCNB2 (0.52) CCNB2CCNE2CDK1CCNB1CCNE1
SCHEMBL27616827 0.85 CCNB2 (0.52) CCNB2CCNE2CDK1CCNB1CCNE1
SCHEMBL11492171 0.84 HPGD (0.48) LMNAALDH1A1CYP3A4MEN1MAPT
SCHEMBL28330270 0.84 LMNA (0.55) CCNB2CCNE2CDK1CCNB1CCNE1
SCHEMBL2799223 0.82 CCNB2 (0.51) CCNB2CCNE2CDK1CCNB1CCNE1
SCHEMBL5474558 0.82 CCNB2 (0.51) CCNB2CCNE2CDK1CCNB1CCNE1
SCHEMBL5480607 0.82 CCNB2 (0.51) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106459553-B Poly carbonate resin composition and its formed body 三菱瓦斯化学株式会社 2018-01-19 CN disclosed
CN-106459553-A Polycarbonate resin composition and article molded therefrom 三菱瓦斯化学株式会社 2017-02-22 CN disclosed