SCHEMBL4257063

SCHEMBL4257063

COC(=O)c1ccc(C=Cc2ccc(O)c(OC)c2)cc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.75
NFE2L2 Q16236 3/20 0.65
CYP2D6 P10635 3/20 0.64
ALOX5 P09917 3/20 0.64
NFKB1 P19838 3/20 0.64
STAT3 P40763 3/20 0.64
NFKB2 Q00653 3/20 0.64
RELA Q04206 3/20 0.64
APP P05067 3/20 0.64
CYP2C9 P11712 2/20 0.64
TSHR P16473 2/20 0.64
HSD17B10 Q99714 2/20 0.64
CYP1A2 P05177 2/20 0.64
HSD11B1 P28845 2/20 0.64
ABCB1 P08183 2/20 0.64
AKR1B1 P15121 2/20 0.64
MAOA P21397 2/20 0.64
MAOB P27338 2/20 0.64
KDM4E B2RXH2 2/20 0.64
CA12 O43570 2/20 0.64

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
SCHEMBL4257060 1.00 PTPN1 (0.75) PTPN1NFE2L2CYP2D6ALOX5NFKB1
SCHEMBL3198192 0.90 APP (0.82) NFE2L2CYP2D6ALOX5NFKB1STAT3
SCHEMBL3198180 0.90 APP (0.82) NFE2L2CYP2D6ALOX5NFKB1STAT3
SCHEMBL4265337 0.88 MAPT (0.74) PTPN1NFE2L2HSD17B10CYP1A2KDM4E
SCHEMBL4265340 0.88 MAPT (0.74) PTPN1NFE2L2HSD17B10CYP1A2KDM4E
SCHEMBL5692905 0.86 CXCL12 (0.79) NFE2L2CYP2D6ALOX5NFKB1STAT3
SCHEMBL5692902 0.86 CXCL12 (0.79) NFE2L2CYP2D6ALOX5NFKB1STAT3
SCHEMBL4257415 0.86 PTPN1 (0.63) PTPN1CYP2D6APPCYP2C9CYP1A2
SCHEMBL4257418 0.86 PTPN1 (0.63) PTPN1CYP2D6APPCYP2C9CYP1A2
SCHEMBL3670444 0.86 PTPN1 (1.00) PTPN1ALOX5RELAAPPCYP2C9

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 PTPN1 4044/4885NFE2L2 6/4885CYP2D6 2469/4885
US-20030073712-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods HSF1, HMOX1, NQO1 PTPN1 4044/4885NFE2L2 6/4885CYP2D6 2469/4885
US-20050113416-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods HSF1, HMOX1, NQO1 PTPN1 4044/4885NFE2L2 6/4885CYP2D6 2469/4885
US-20060178356-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods HSF1, HMOX1, NQO1 PTPN1 4044/4885NFE2L2 6/4885CYP2D6 2469/4885

“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.