SCHEMBL4258221

SCHEMBL4258221

O=C1CC(c2ccc(C=Cc3ccc(O)c(O)c3)cc2)=NO1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.51
LCK P06239 3/20 0.47
NQO2 P16083 3/20 0.46
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
KDM4E B2RXH2 4/20 0.43
HSD17B10 Q99714 4/20 0.43
ALDH1A1 P00352 3/20 0.43
LMNA P02545 3/20 0.43
POLB P06746 3/20 0.43
MAPT P10636 3/20 0.43
HPGD P15428 3/20 0.43
PMP22 Q01453 3/20 0.43
TDP1 Q9NUW8 3/20 0.43
CYP3A4 P08684 3/20 0.43
CYP2C9 P11712 3/20 0.43
HIF1A Q16665 3/20 0.43
PTPN1 P18031 3/20 0.43
ALOX12 P18054 3/20 0.43
APEX1 P27695 2/20 0.43

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
SCHEMBL4258219 1.00 NOTUM (0.51) NOTUMLCKNQO2MAOAMAOB
SCHEMBL10335571 0.71 LCK (0.94) LCKNQO2KDM4EHSD17B10ALDH1A1
SCHEMBL3667066 0.69 MEN1 (0.52) LCKNQO2MAOBKDM4EALDH1A1
SCHEMBL3667064 0.69 MEN1 (0.52) LCKNQO2MAOBKDM4EALDH1A1
SCHEMBL1824175 0.69 LCK (1.00) LCKNQO2KDM4EHSD17B10ALDH1A1
SCHEMBL30631591 0.69 LCK (1.00) LCKNQO2KDM4EHSD17B10ALDH1A1
SCHEMBL31706727 0.69 LCK (1.00) LCKNQO2KDM4EHSD17B10ALDH1A1
SCHEMBL1824176 0.69 LCK (1.00) LCKNQO2KDM4EHSD17B10ALDH1A1
SCHEMBL9782150 0.69 NOTUM (1.00) NOTUMKDM4EALDH1A1LMNAMAPT
SCHEMBL31178428 0.67 NOTUM (0.65) NOTUMLMNAMAPTGAATP53

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050142155-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods JOHNSON & JOHNSON CONSUMER INC. 2005-06-30 US claimed
US-7629375-B2 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods JOHNSON & JOHNSON CONSUMER COMPANIES, INC. (US) 2009-12-08 US disclosed
US-20060178356-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods GALILEO PHARMACEUTICALS, INC. 2006-08-10 US disclosed
EP-1435894-A4 CYTOPROTECTIVE COMPOUNDS, PHARMACEUTICAL AND COSMETIC FORMULATIONS, AND METHODS GALILEO PHARMACEUTICALS INC (US) 2005-07-06 EP disclosed
US-20050142155-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods JOHNSON & JOHNSON CONSUMER INC. 2005-06-30 US disclosed
US-20050113416-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods GALILEO PHARMACEUTICALS, INC. 2005-05-26 US disclosed
EP-1435894-A2 CYTOPROTECTIVE COMPOUNDS, PHARMACEUTICAL AND COSMETIC FORMULATIONS, AND METHODS Galileo Pharmaceuticals, Inc. (US) 2004-07-14 EP disclosed
US-20030073712-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods JOHNSON & JOHNSON CONSUMER COMPANIES, INC. 2003-04-17 US disclosed
WO-2003009807-A2 CYTOPROTECTIVE COMPOUNDS, PHARMACEUTICAL AND COSMETIC FORMULATIONS, AND METHODS GALILEO LABORATORIES, INC. (US) 2003-02-06 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050142155-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods HSF1, HMOX1, NQO1 NOTUM 855/4885LCK 2046/4885NQO2 712/4885
US-20030073712-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods HSF1, HMOX1, NQO1 NOTUM 855/4885LCK 2046/4885NQO2 712/4885
US-20050113416-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods HSF1, HMOX1, NQO1 NOTUM 855/4885LCK 2046/4885NQO2 712/4885
US-20060178356-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods HSF1, HMOX1, NQO1 NOTUM 855/4885LCK 2046/4885NQO2 712/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.