SCHEMBL10899554

SCHEMBL10899554

CCC(CC)OC1=CC(=O)c2ccccc2C1=O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC25B P30305 3/20 0.62
IDO1 P14902 3/20 0.62
CDC25A P30304 2/20 0.62
GAPDH P04406 1/20 0.54
PTPRC P08575 1/20 0.53
SOAT1 P35610 9/20 0.49
S100A4 P26447 4/20 0.49
PTPN1 P18031 1/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
PLIN1 O60240 1/20 0.48
NR1I2 O75469 1/20 0.48
USP2 O75604 1/20 0.48
ALDH1A1 P00352 1/20 0.48
GSR P00390 1/20 0.48
LMNA P02545 1/20 0.48
TP53 P04637 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
ADORA3 P0DMS8 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
SCHEMBL9627371 0.86 CDC25B (0.59) CDC25BIDO1CDC25AGAPDHPTPRC
SCHEMBL8744491 0.81 CDC25B (0.67) CDC25BIDO1CDC25AGAPDHPTPRC
SCHEMBL9629381 0.80 CDC25B (0.56) CDC25BIDO1CDC25AGAPDHPTPRC
SCHEMBL2511730 0.80 CDC25B (0.74) CDC25BIDO1CDC25AGAPDHPTPRC
SCHEMBL29800450 0.80 CDC25B (0.74) CDC25BIDO1CDC25AGAPDHPTPRC
SCHEMBL28036548 0.79 CDC25B (0.54) CDC25BIDO1CDC25AGAPDHPTPRC
SCHEMBL10446232 0.78 CDC25B (0.53) CDC25BIDO1CDC25AGAPDHPTPRC
SCHEMBL9628358 0.77 CDC25B (0.61) CDC25BIDO1CDC25AGAPDHPTPRC
2-Methoxy-1,4-Naphthoquinone SCHEMBL29401525 0.77 CDC25B (1.00) CDC25BIDO1CDC25AGAPDHPTPRC
2-Methoxy-1,4-Naphthoquinone SCHEMBL571061 0.77 CDC25B (1.00) CDC25BIDO1CDC25AGAPDHPTPRC

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-0178904-A2 Quinone synthesis ENERGY CONVERSION DEVICES, INC. (US) 1986-04-23 EP disclosed