SCHEMBL514323

SCHEMBL514323

O=C(Cl)c1ccc(OCc2ccccc2)c(OCc2ccccc2)c1OCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.50
MAPT P10636 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
GLRA1 P23415 1/20 0.49
FOLH1 Q04609 1/20 0.48
PDE4D Q08499 1/20 0.46
ALDH1A1 P00352 2/20 0.46
PTGER1 P34995 1/20 0.46
PTPN1 P18031 1/20 0.46
SGMS2 Q8NHU3 2/20 0.46
THRA P10827 1/20 0.44
THRB P10828 1/20 0.44
CHRM4 P08173 1/20 0.44
CHRM3 P20309 1/20 0.44
CLCN2 P51788 1/20 0.44
MCL1 Q07820 1/20 0.44
KDM4E B2RXH2 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
SCHEMBL16789583 0.92 GLRA1 (0.55) L3MBTL1MAPTCYP2C9CYP2C19SMN1; SMN2
SCHEMBL11112757 0.88 CHRM4 (0.48) L3MBTL1MAPTCYP2C9CYP2C19SMN1; SMN2
SCHEMBL6476026 0.88 SGMS2 (0.52) L3MBTL1MAPTSMN1; SMN2TDP1GLRA1
SCHEMBL2229263 0.87 FOLH1 (0.57) L3MBTL1MAPTCYP2C9CYP2C19SMN1; SMN2
SCHEMBL28361495 0.87 MAPT (0.57) L3MBTL1MAPTCYP2C9CYP2C19SMN1; SMN2
Hydrochloric Acid SCHEMBL514324 0.86 FOLH1 (0.56) L3MBTL1MAPTCYP2C9CYP2C19SMN1; SMN2
SCHEMBL30184648 0.84 PARP1 (0.54) L3MBTL1MAPTCYP2C9CYP2C19SMN1; SMN2
SCHEMBL26021326 0.84 MAPT (0.65) L3MBTL1MAPTCYP2C9CYP2C19SMN1; SMN2
SCHEMBL9336507 0.83 MAPT (0.63) L3MBTL1MAPTCYP2C9CYP2C19SMN1; SMN2
SCHEMBL18499402 0.83 ALDH1A1 (0.55) L3MBTL1MAPTCYP2C9CYP2C19SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9399631-B2 Polyphenol proteasome inhibitors, synthesis, and methods of use UNIVERSITY OF SOUTH FLORIDA (US) 2016-07-26 US disclosed
US-20140045931-A1 POLYPHENOL PROTEASOME INHIBITORS, SYNTHESIS, AND METHODS OF USE THE HONG KONG POLYTECHNIC UNIVERSITY (HK) 2014-02-13 US disclosed
US-8563607-B2 Polyphenol proteasome inhibitors, synthesis, and methods of use UNIVERSITY OF SOUTH FLORIDA (US) 2013-10-22 US disclosed
US-20120029067-A1 Polyphenol Proteasome Inhibitors, Synthesis, and Methods of Use UNIVERSITY OF SOUTH FLORIDA (US) 2012-02-02 US disclosed
US-8058310-B2 Polyphenol proteasome inhibitors, synthesis, and methods of use UNIVERSITY OF SOUTH FLORIDA (US) 2011-11-15 US disclosed
US-7767711-B2 Polyphenol proteasome inhibitors, synthesis, and methods of use UNIVERSITY OF SOUTH FLORIDA (US) 2010-08-03 US disclosed
US-20100173985-A1 Polyphenol proteasome inhibitors, synthesis, and methods of use UNIVERSITY OF SOUTH FLORIDA (US) 2010-07-08 US disclosed
US-7358383-B2 Polyphenol proteasome inhibitors, synthesis, and methods of use UNIVERSITY OF SOUTH FLORIDA (US) 2008-04-15 US disclosed
US-20080015248-A1 Polyphenol proteasome inhibitors, synthesis, and methods of use DOU Q P 2008-01-17 US disclosed
US-20040186167-A1 Polyphenol proteasome inhibitors, synthesis, and methods of use THE HONG KONG POLYTECHNIC UNIVERSITY (CN) 2004-09-23 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 (5 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-20140045931-A1 POLYPHENOL PROTEASOME INHIBITORS, SYNTHESIS, AND METHODS OF USE PSMC1, PSMB5, PSMC5 L3MBTL1 3328/4885MAPT 481/4885CYP2C9 3770/4885
US-20080015248-A1 Polyphenol proteasome inhibitors, synthesis, and methods of use PSMC1, PSMB5, PSMC5 L3MBTL1 3328/4885MAPT 481/4885CYP2C9 3770/4885
US-20100173985-A1 Polyphenol proteasome inhibitors, synthesis, and methods of use PSMC1, PSMB5, PSMC5 L3MBTL1 3328/4885MAPT 481/4885CYP2C9 3770/4885
US-20120029067-A1 Polyphenol Proteasome Inhibitors, Synthesis, and Methods of Use PSMC1, PSMB5, PSMC5 L3MBTL1 3328/4885MAPT 481/4885CYP2C9 3770/4885
US-20040186167-A1 Polyphenol proteasome inhibitors, synthesis, and methods of use PSMC1, PSMB5, PSMC5 L3MBTL1 3328/4885MAPT 481/4885CYP2C9 3770/4885

“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.