SCHEMBL28118214

SCHEMBL28118214

O=COc1cccc2cc(O)c(O)cc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.39
GRIN2A Q12879 1/20 0.39
GRIN2B Q13224 1/20 0.39
GRIN2C Q14957 1/20 0.39
TRPM4 Q8TD43 1/20 0.38
KMT2A Q03164 3/20 0.38
POLB P06746 2/20 0.38
GAA P10253 2/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 2/20 0.38
HSD17B10 Q99714 2/20 0.38
PLAU P00749 1/20 0.34
ERN1 O75460 3/20 0.34
NQO2 P16083 1/20 0.33
MIF P14174 2/20 0.33
DAO P14920 1/20 0.33
ESR1 P03372 3/20 0.33
ESR2 Q92731 3/20 0.33
MEN1 O00255 2/20 0.33

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
SCHEMBL214710 0.81 ALDH1A1 (0.42) KMT2AGAAKDM4EALDH1A1HPGD
SCHEMBL15866722 0.81 GRIN2D (0.45) GRIN2DGRIN2AGRIN2BGRIN2CTRPM4
SCHEMBL27928972 0.81 GRIN2D (0.49) GRIN2DGRIN2AGRIN2BGRIN2CKMT2A
SCHEMBL27768980 0.81 SLC6A2 (0.41) POLBNQO2ESR1ESR2THRB
SCHEMBL28934878 0.80 ALDH1A1 (0.41) KMT2AGAAKDM4EALDH1A1HPGD
SCHEMBL28934953 0.80 ALDH1A1 (0.41) KMT2AGAAKDM4EALDH1A1HPGD
SCHEMBL28934913 0.80 ALDH1A1 (0.41) KMT2AGAAKDM4EALDH1A1HPGD
SCHEMBL28934902 0.80 ALDH1A1 (0.41) KMT2AGAAKDM4EALDH1A1HPGD
SCHEMBL28934937 0.80 ALDH1A1 (0.41) KMT2AGAAKDM4EALDH1A1HPGD
SCHEMBL28934949 0.80 ALDH1A1 (0.41) KMT2AGAAKDM4EALDH1A1HPGD

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-106188489-A A kind of runway rubber compositions and goods thereof 上海微谱化工技术服务有限公司 2016-12-07 CN disclosed