SCHEMBL4254430

SCHEMBL4254430

CCOC(=O)c1ccc(C=Cc2ccc(C=Cc3ccc(OC)c(OC)c3OC)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.57
ABCG2 Q9UNQ0 1/20 0.56
CYP1A1 P04798 4/20 0.55
CYP1B1 Q16678 4/20 0.55
CYP1A2 P05177 3/20 0.47
CYP2D6 P10635 3/20 0.47
NFE2L2 Q16236 2/20 0.47
HSD17B2 P37059 1/20 0.47
CHRNA7 P36544 1/20 0.46
MAPT P10636 3/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
GAA P10253 1/20 0.46
KDM4E B2RXH2 2/20 0.45
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
ESR1 P03372 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44

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
SCHEMBL4259584 1.00 CYP19A1 (0.57) CYP19A1ABCG2CYP1A1CYP1B1CYP1A2
SCHEMBL4261137 0.87 CYP19A1 (0.62) CYP19A1ABCG2CYP1A1CYP1B1CYP1A2
SCHEMBL4262785 0.86 MEN1 (0.55) CYP19A1ABCG2CYP1A1CYP1B1CYP1A2
SCHEMBL3676648 0.86 GAA (0.53) CYP19A1ABCG2CYP1A1CYP1B1MAPT
SCHEMBL4256018 0.85 CYP19A1 (0.49) CYP19A1ABCG2CYP1A1CYP1B1CYP1A2
SCHEMBL6105396 0.84 HSD17B2 (0.49) ABCG2CYP1A2NFE2L2HSD17B2MAPT
SCHEMBL6105390 0.84 HSD17B2 (0.49) ABCG2CYP1A2NFE2L2HSD17B2MAPT
SCHEMBL4254562 0.82 CYP19A1 (0.64) CYP19A1ABCG2CYP1A1CYP1B1CYP1A2
SCHEMBL4258450 0.81 GAA (0.47) CYP19A1ABCG2CYP1A1CYP1B1CYP1A2
SCHEMBL4262025 0.81 MAPT (0.60) ABCG2CYP1A1CYP1B1CYP1A2NFE2L2

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 CYP19A1 2245/4885ABCG2 1613/4885CYP1A1 1550/4885
US-20030073712-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods HSF1, HMOX1, NQO1 CYP19A1 2245/4885ABCG2 1613/4885CYP1A1 1550/4885
US-20050113416-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods HSF1, HMOX1, NQO1 CYP19A1 2245/4885ABCG2 1613/4885CYP1A1 1550/4885
US-20060178356-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods HSF1, HMOX1, NQO1 CYP19A1 2245/4885ABCG2 1613/4885CYP1A1 1550/4885

“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.