SCHEMBL4259131

SCHEMBL4259131

COC(=O)c1ccc(/C=C/c2ccc(O)c(Br)c2)cc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.75
MKNK2 Q9HBH9 1/20 0.59
HSD17B3 P37058 1/20 0.56
PTGS2 P35354 1/20 0.52
CA12 O43570 2/20 0.51
CA1 P00915 2/20 0.51
CA2 P00918 2/20 0.51
CA7 P43166 2/20 0.51
CA9 Q16790 2/20 0.51
CA14 Q9ULX7 2/20 0.51
ALDH1A1 P00352 2/20 0.51
XDH P47989 1/20 0.51
APP P05067 1/20 0.50
CCR6 P51684 1/20 0.50
HKDC1 Q2TB90 1/20 0.50
PRMT1 Q99873 1/20 0.50
LY96 Q9Y6Y9 2/20 0.49
LMNA P02545 4/20 0.48
MAPT P10636 4/20 0.48
MEN1 O00255 2/20 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
SCHEMBL4259132 1.00 PTPN1 (0.75) PTPN1MKNK2HSD17B3PTGS2CA12
SCHEMBL4267545 0.86 PTPN1 (0.63) PTPN1PTGS2CA12CA1CA2
SCHEMBL4267543 0.86 PTPN1 (0.63) PTPN1PTGS2CA12CA1CA2
SCHEMBL3670444 0.86 PTPN1 (1.00) PTPN1PTGS2CA12CA1CA2
SCHEMBL4257400 0.86 PTPN1 (1.00) PTPN1PTGS2CA12CA1CA2
SCHEMBL4257397 0.86 PTPN1 (1.00) PTPN1PTGS2CA12CA1CA2
SCHEMBL3670446 0.86 PTPN1 (1.00) PTPN1PTGS2CA12CA1CA2
Hydrochloric Acid SCHEMBL6138203 0.84 PTPN1 (0.97) PTPN1PTGS2CA12CA1CA2
Hydrochloric Acid SCHEMBL6138208 0.84 PTPN1 (0.97) PTPN1PTGS2CA12CA1CA2
SCHEMBL382159 0.82 CA1 (0.69) PTPN1HSD17B3CA12CA1CA2

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 5 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
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
US-20030073712-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods JOHNSON & JOHNSON CONSUMER COMPANIES, INC. 2003-04-17 US 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 4044/4885MKNK2 3104/4885HSD17B3 1286/4885
US-20030073712-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods HSF1, HMOX1, NQO1 PTPN1 4044/4885MKNK2 3104/4885HSD17B3 1286/4885
US-20050113416-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods HSF1, HMOX1, NQO1 PTPN1 4044/4885MKNK2 3104/4885HSD17B3 1286/4885
US-20060178356-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods HSF1, HMOX1, NQO1 PTPN1 4044/4885MKNK2 3104/4885HSD17B3 1286/4885

“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.