SCHEMBL4257370

SCHEMBL4257370

CC(=NO)c1ccc(C=Cc2ccc(O)c(O)c2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 3/20 0.66
LCK P06239 4/20 0.59
NQO2 P16083 3/20 0.56
PTPN1 P18031 3/20 0.55
RELA Q04206 1/20 0.53
ALOX12 P18054 2/20 0.50
ALOX5 P09917 2/20 0.50
MAPT P10636 2/20 0.50
RGS12 O14924 1/20 0.50
TP53 P04637 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C9 P11712 1/20 0.50
PKM P14618 1/20 0.50
ALOX15 P16050 1/20 0.50
CASP1 P29466 1/20 0.50
THPO P40225 1/20 0.50
GNAI1 P63096 1/20 0.50
HIF1A Q16665 1/20 0.50
HSD17B10 Q99714 1/20 0.50

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
SCHEMBL4257368 1.00 KDM1A (0.66) KDM1ALCKNQO2PTPN1RELA
SCHEMBL28836347 0.79 KDM1A (1.00) KDM1ALCKNQO2PTPN1ALOX12
SCHEMBL14330300 0.79 POLB (0.48) KDM1AMAPTCYP1A2CYP3A4KDM4E
SCHEMBL13927323 0.79 POLB (0.48) KDM1AMAPTCYP1A2CYP3A4KDM4E
SCHEMBL7097648 0.79 POLB (0.48) KDM1AMAPTCYP1A2CYP3A4KDM4E
SCHEMBL10335571 0.79 LCK (0.94) KDM1ALCKNQO2PTPN1RELA
SCHEMBL31706727 0.77 LCK (1.00) LCKNQO2PTPN1RELAALOX12
SCHEMBL1824175 0.77 LCK (1.00) LCKNQO2PTPN1RELAALOX12
SCHEMBL30631591 0.77 LCK (1.00) LCKNQO2PTPN1RELAALOX12
SCHEMBL1824176 0.77 LCK (1.00) LCKNQO2PTPN1RELAALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 KDM1A 3643/4885LCK 2046/4885NQO2 712/4885
US-20030073712-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods HSF1, HMOX1, NQO1 KDM1A 3643/4885LCK 2046/4885NQO2 712/4885
US-20050113416-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods HSF1, HMOX1, NQO1 KDM1A 3643/4885LCK 2046/4885NQO2 712/4885
US-20060178356-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods HSF1, HMOX1, NQO1 KDM1A 3643/4885LCK 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.