SCHEMBL10077707

SCHEMBL10077707

CNCc1ccc(/C=C/C(=O)CC(=O)/C=C/c2ccc(O)c(OC)c2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MMP9 P14780 5/20 1.00
▸ APP P05067 10/20 0.78
▸ MAPT P10636 9/20 0.78
▸ BACE1 P56817 5/20 0.78
▸ NFKB1 P19838 3/20 0.78
▸ CYP2D6 P10635 2/20 0.78
▸ CYP2C9 P11712 2/20 0.78
▸ TSHR P16473 2/20 0.78
▸ HSD17B10 Q99714 2/20 0.78
▸ ABCB1 P08183 2/20 0.78
▸ AKR1B1 P15121 2/20 0.78
▸ MAOA P21397 2/20 0.78
▸ MAOB P27338 2/20 0.78
▸ HDAC3 O15379 2/20 0.78
▸ HDAC1 Q13547 2/20 0.78
▸ HDAC2 Q92769 2/20 0.78
▸ HDAC6 Q9UBN7 2/20 0.78
▸ ALOX5 P09917 2/20 0.78
▸ STAT3 P40763 2/20 0.78
▸ NFKB2 Q00653 2/20 0.78

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
Curcumin SCHEMBL15380842 0.89 APP (0.97) MMP9APPMAPTBACE1NFKB1
Curcumin SCHEMBL15380838 0.89 APP (0.97) MMP9APPMAPTBACE1NFKB1
Curcumin SCHEMBL29636029 0.89 APP (0.97) MMP9APPMAPTBACE1NFKB1
Curcumin SCHEMBL6901740 0.88 APP (1.00) MMP9APPMAPTBACE1NFKB1
Curcumin SCHEMBL2804734 0.88 APP (1.00) MMP9APPMAPTBACE1NFKB1
Curcumin SCHEMBL250984 0.88 APP (1.00) MMP9APPMAPTBACE1NFKB1
Curcumin SCHEMBL17629819 0.88 APP (1.00) MMP9APPMAPTBACE1NFKB1
Curcumin SCHEMBL8440 0.88 APP (1.00) MMP9APPMAPTBACE1NFKB1
Curcumin SCHEMBL8336603 0.88 APP (1.00) MMP9APPMAPTBACE1NFKB1
Curcumin SCHEMBL17629818 0.88 APP (1.00) MMP9APPMAPTBACE1NFKB1

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-9675576-B2 Polyenolic zinc-binding agents (pezbins) actively promote inactivation of cancer stem cells and potentiate cytotoxic anti-tumor drug substances THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2017-06-13 — — US disclosed
US-20170158605-A1 CURCUMIN ANALOGUES AS ZINC CHELATORS AND THEIR USES THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2017-06-08 — — US disclosed
US-9556105-B2 Curcumin analogues as zinc chelators and their uses THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2017-01-31 — — US disclosed
US-20160213638-A1 POLYENOLIC ZINC-BINDING AGENTS (PEZBINS) ACTIVELY PROMOTE INACTIVATION OF CANCER STEM CELLS AND POTENTIATE CYTOTOXIC ANTI-TUMOR DRUG SUBSTANCES THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2016-07-28 — — US disclosed
US-20160031795-A1 CURCUMIN ANALOGUES AS ZINC CHELATORS AND THEIR USES THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2016-02-04 — — US disclosed
US-9220695-B2 Polyenolic zinc-binding agents (pezbins) actively promote inactivation of cancer stem cells and potentiate cytotoxic anti-tumor drug substances THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2015-12-29 — — US disclosed
US-9187406-B2 Curcumin analogues as zinc chelators and their uses THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2015-11-17 — — US disclosed
US-20150150834-A1 POLYENOLIC ZINC-BINDING AGENTS (PEZBINS) ACTIVELY PROMOTE INACTIVATION OF CANCER STEM CELLS AND POTENTIATE CYTOTOXIC ANTI-TUMOR DRUG SUBSTANCES CHEM-MASTER INTERNATIONAL, INC. (US) 2015-06-04 — — US disclosed
US-20150073021-A1 CHEMICALLY MODIFIED CURCUMINS AS INHIBITORS OF ANTHRAX LETHAL FACTOR THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2015-03-12 — — US disclosed
US-20120095051-A1 CURCUMIN ANALOGUES AS ZINC CHELATORS AND THEIR USES CHEM-MASTER INTERNATIONAL, INC. 2012-04-19 — — 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 (6 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-20160213638-A1 POLYENOLIC ZINC-BINDING AGENTS (PEZBINS) ACTIVELY PROMOTE INACTIVATION OF CANCER STEM CELLS AND POTENTIATE CYTOTOXIC ANTI-TUMOR DRUG SUBSTANCES BAZ2B, CEBPZ, BAZ2A MMP9 1634/4885APP 4374/4885MAPT 4394/4885
US-20150073021-A1 CHEMICALLY MODIFIED CURCUMINS AS INHIBITORS OF ANTHRAX LETHAL FACTOR ANTXR2, APAF1, LITAF MMP9 1104/4885APP 569/4885MAPT 3945/4885
US-20120095051-A1 CURCUMIN ANALOGUES AS ZINC CHELATORS AND THEIR USES NFKBIA, NFKB1, NFKB2 MMP9 12/4885APP 352/4885MAPT 3287/4885
US-20150150834-A1 POLYENOLIC ZINC-BINDING AGENTS (PEZBINS) ACTIVELY PROMOTE INACTIVATION OF CANCER STEM CELLS AND POTENTIATE CYTOTOXIC ANTI-TUMOR DRUG SUBSTANCES BAZ2B, CEBPZ, BAZ2A MMP9 1634/4885APP 4374/4885MAPT 4394/4885
US-20170158605-A1 CURCUMIN ANALOGUES AS ZINC CHELATORS AND THEIR USES NFKBIA, NFKB1, NFKB2 MMP9 12/4885APP 352/4885MAPT 3287/4885
US-20160031795-A1 CURCUMIN ANALOGUES AS ZINC CHELATORS AND THEIR USES NFKBIA, NFKB1, NFKB2 MMP9 12/4885APP 352/4885MAPT 3287/4885

“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.

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